C30H30N2O8 Uridine, 5'-O-[bis (4-methoxyphenyl) phenylmethyl] - (9CI, ACI)
Mabuɗin Abubuwan Jiki | Daraja | Sharadi |
Nauyin Kwayoyin Halitta | 546.57 | - |
Wurin narkewa (Gwaji) | 111-112 ° C | Mai narkewa: ethyl acetate |
Girma (An annabta) | 1.343± 0.06 g/cm3 | Zazzabi: 20 ° C; Latsa: 760 Torr |
pKa (An annabta) | 9.39± 0.10 | Mafi yawan zafin jiki: 25 ° C |
Canonical SMILES O=C1C=CN(C(=O)N1)C2OC(COC(C=3C=CC=CC3)(C4=CC=C(OC)C=C4)C5=CC=C(OC)C= C5)C(O)C2O
Isomeric SMILES C (OC [C@H] 1O[C@H]([C@H](O)[C@@H] 1O) N2C(=O)NC(=O)C=C2)(C3= CC=C(OC)C=C3)(C4=CC=C(OC)C=C4)C5=CC=CC=C5
InChi
InChi=1S/C30H30N2O8/c1-37-22-12-8-20(9-13-22)30(19-6-4-3-5-7- 19,21-10-14-23(38-2)15-11-21)39-18-24-26(34)27(35)28(40-24)32-
17-16-25(33)31-29(32)36/h3-17,24,26-28,34-35H,18H2,1-2H3,(H,31,33,36)/t24-,26 -,27-,28-/m1/s1
InChi Key
PCFSNQYXXACUHM-YULOIDQLSA-N
4 Wasu Sunaye na wannan Abu
5′-O-[Bis (4-methoxyphenyl) phenylmethyl] uridine (ACI); Uridine, 5'-O-[α, α-bis(p-methoxyphenyl) benzyl] - (7CI); 5'-Dimethoxytrityl uridine; 5'-O- (4,4'-Dimethoxytril) uridine
Properties akwai |
Thermal |
Thermal
Dukiya | Daraja | Sharadi | Source | |
Matsayin narkewa | 122-123 ° C | (1) CAS | ||
Matsayin narkewa | 111-112 ° C | Mai narkewa: | Ethyl acetate | (2) CAS |
Matsayin narkewa | Duba Cikakken Rubutu | (3) CAS |
(1) Zekri, Negar; Bulletin na Chemical Society of Ethiopia, (2010), 24(2), 299-304, CAplus
(2) Patil, Premanand Ramrao; Jaridar Carbohydrate Chemistry, (2008), 27 (5), 279-293, CAplus
(3) Khalafi-Nezhad, Ali; Haruffa Tetrahedron, (2004), 45 (36), 6737-6739, CAplus
Spectra akwai
1H NMR
13C NMR
Mass
Properties akwai |
Halittu |
Chemical |
Yawan yawa |
Lipinski |
Tsarin Yanayi |
Halittu
Dukiya | Daraja | Sharadi | Source |
Factor na Bioconcentration | 904 | pH da 1; Zazzabi: 25 ° C | (1) ACD |
Factor na Bioconcentration | 904 | pH da 2; Zazzabi: 25 ° C | (1) ACD |
Factor na Bioconcentration | 904 | pH da 3; Zazzabi: 25 ° C | (1) ACD |
Factor na Bioconcentration | 904 | pH da 4; Zazzabi: 25 ° C | (1) ACD |
Factor na Bioconcentration | 904 | pH da 5; Zazzabi: 25 ° C | (1) ACD |
Factor na Bioconcentration | 904 | pH da 6; Zazzabi: 25 ° C | (1) ACD |
Factor na Bioconcentration | 900 | pH da 7; Zazzabi: 25 ° C | (1) ACD |
Factor na Bioconcentration | 861 | pH da 8; Zazzabi: 25 ° C | (1) ACD |
Factor na Bioconcentration | 602 | pH da 9; Zazzabi: 25 ° C | (1) ACD |
Dukiya | Daraja | Sharadi | Source |
Factor na Bioconcentration | 156 | pH 10; Zazzabi: 25 ° C | (1) ACD |
(1) An ƙididdige ta ta amfani da Ci gaban Chemistry na Babba (ACD/Labs) Software V11.02 (© 1994-2023 ACD/Labs)
Chemical
Dukiya | Daraja | Sharadi | Source |
Koc | 4550 | pH da 1; Zazzabi: 25 ° C | (1) ACD |
Koc | 4550 | pH da 2; Zazzabi: 25 ° C | (1) ACD |
Koc | 4550 | pH da 3; Zazzabi: 25 ° C | (1) ACD |
Koc | 4550 | pH da 4; Zazzabi: 25 ° C | (1) ACD |
Koc | 4550 | pH da 5; Zazzabi: 25 ° C | (1) ACD |
Koc | 4540 | pH da 6; Zazzabi: 25 ° C | (1) ACD |
Koc | 4520 | pH da 7; Zazzabi: 25 ° C | (1) ACD |
Koc | 4330 | pH da 8; Zazzabi: 25 ° C | (1) ACD |
Koc | 3030 | pH da 9; Zazzabi: 25 ° C | (1) ACD |
Koc | 785 | pH 10; Zazzabi: 25 ° C | (1) ACD |
logD | 4.19 | pH da 1; Zazzabi: 25 ° C | (1) ACD |
logD | 4.19 | pH da 2; Zazzabi: 25 ° C | (1) ACD |
logD | 4.19 | pH da 3; Zazzabi: 25 ° C | (1) ACD |
logD | 4.19 | pH da 4; Zazzabi: 25 ° C | (1) ACD |
logD | 4.19 | pH da 5; Zazzabi: 25 ° C | (1) ACD |
logD | 4.19 | pH da 6; Zazzabi: 25 ° C | (1) ACD |
logD | 4.19 | pH da 7; Zazzabi: 25 ° C | (1) ACD |
logD | 4.17 | pH da 8; Zazzabi: 25 ° C | (1) ACD |
logD | 4.02 | pH da 9; Zazzabi: 25 ° C | (1) ACD |
logD | 3.43 | pH 10; Zazzabi: 25 ° C | (1) ACD |
logP | 4.192± 0.628 | Zazzabi: 25 ° C | (1) ACD |
Mass Intrinsic Solubility | 3.2 x 10-4 g/L | Zazzabi: 25 ° C | (1) ACD |
Mass Solubility | 3.2 x 10-4 g/L | pH da 1; Zazzabi: 25 ° C | (1) ACD |
Mass Solubility | 3.2 x 10-4 g/L | pH da 2; Zazzabi: 25 ° C | (1) ACD |
Mass Solubility | 3.2 x 10-4 g/L | pH da 3; Zazzabi: 25 ° C | (1) ACD |
Mass Solubility | 3.2 x 10-4 g/L | pH da 4; Zazzabi: 25 ° C | (1) ACD |
Mass Solubility | 3.2 x 10-4 g/L | pH da 5; Zazzabi: 25 ° C | (1) ACD |
Mass Solubility | 3.2 x 10-4 g/L | pH da 6; Zazzabi: 25 ° C | (1) ACD |
Mass Solubility | 3.2 x 10-4 g/L | pH da 7; Zazzabi: 25 ° C | (1) ACD |
Dukiya | Daraja | Sharadi | Source |
Mass Solubility | 3.3 x 10-4 g/L | pH da 8; Zazzabi: 25 ° C | (1) ACD |
Mass Solubility | 4.8 x 10-4 g/L | pH da 9; Zazzabi: 25 ° C | (1) ACD |
Mass Solubility | 1.9 x 10-3 g/L | pH 10; Zazzabi: 25 ° C | (1) ACD |
Mass Solubility | 3.2 x 10-4 g/L | Ruwan da ba a buƙata ba pH 6.99; Zazzabi: 25 ° C | (1) ACD |
Solubility na Ciki na Molar | 5.8 x 10-7 mol/L | Zazzabi: 25 ° C | (1) ACD |
Solubility na Molar | 5.8 x 10-7 mol/L | pH da 1; Zazzabi: 25 ° C | (1) ACD |
Solubility na Molar | 5.8 x 10-7 mol/L | pH da 2; Zazzabi: 25 ° C | (1) ACD |
Solubility na Molar | 5.8 x 10-7 mol/L | pH da 3; Zazzabi: 25 ° C | (1) ACD |
Solubility na Molar | 5.8 x 10-7 mol/L | pH da 4; Zazzabi: 25 ° C | (1) ACD |
Solubility na Molar | 5.8 x 10-7 mol/L | pH da 5; Zazzabi: 25 ° C | (1) ACD |
Solubility na Molar | 5.8 x 10-7 mol/L | pH da 6; Zazzabi: 25 ° C | (1) ACD |
Solubility na Molar | 5.8 x 10-7 mol/L | pH da 7; Zazzabi: 25 ° C | (1) ACD |
Solubility na Molar | 6.1 x 10-7 mol/L | pH da 8; Zazzabi: 25 ° C | (1) ACD |
Solubility na Molar | 8.7 x 10-7 mol/L | pH da 9; Zazzabi: 25 ° C | (1) ACD |
Solubility na Molar | 3.4 x 10-6 mol/L | pH 10; Zazzabi: 25 ° C | (1) ACD |
Solubility na Molar | 5.8 x 10-7 mol/L | Ruwan da ba a buƙata ba pH 6.99; Zazzabi: 25 ° C | (1) ACD |
Nauyin Kwayoyin Halitta | 546.57 | ||
pKa | 9.39± 0.10 | Mafi yawan zafin jiki: 25 ° C | (1) ACD |
(1) An ƙididdige ta ta amfani da Ci gaban Chemistry na Babba (ACD/Labs) Software V11.02 (© 1994-2023 ACD/Labs)
Yawan yawa
Dukiya | Daraja | Sharadi | Source |
Yawan yawa | 1.343± 0.06 g/cm3 | Zazzabi: 20 ° C; Latsa: 760 Torr | (1) ACD |
Ƙarar Molar | 406.9± 3.0 cm3/mol | Zazzabi: 20 ° C; Latsa: 760 Torr | (1) ACD |
(1) An ƙididdige ta ta amfani da Ci gaban Chemistry na Babba (ACD/Labs) Software V11.02 (© 1994-2023 ACD/Labs)
Lipinski
Dukiya | Daraja | Sharadi | Source |
Ƙimar Rarraba Kyauta | 11 | (1) ACD | |
H Masu karɓa | 10 | (1) ACD | |
H Masu Ba da taimako | 3 | (1) ACD | |
H Donor/Acceptor Sum | 13 | (1) ACD | |
logP | 4.192± 0.628 | Zazzabi: 25 ° C | (1) ACD |
Dukiya | Daraja | Sharadi | Source |
Nauyin Kwayoyin Halitta | 546.57 |
(1) An ƙididdige ta ta amfani da Ci gaban Chemistry na Babba (ACD/Labs) Software V11.02 (© 1994-2023 ACD/Labs)
Tsarin Yanayi
Dukiya | Daraja | Sharadi | Source |
Wuri Mai Girma | 127 A2 | (1) ACD |
(1) An ƙididdige ta ta amfani da Ci gaban Chemistry na Babba (ACD/Labs) Software V11.02 (© 1994-2023 ACD/Labs)
Spectra akwai
1H NMR
13C NMR