ChemDiv1_010833
ethyl 2-[[3-cyano-4-(4-methoxyphenyl)-6-methyl-5-(phenylcarbamoyl)-2-pyridinyl]sulfanyl]acetate
Also Known As: ChemDiv1_010833|HMS617M09|AE-848/07783053|SR-01000507408-1|ethyl 2-((3-cyano-4-(4-methoxyphenyl)-6-methyl-5-(phenylcarbamoyl)pyridin-2-yl)thio)acetate|ethyl {[3-cyano-4-(4-methoxyphenyl)-6-methyl-5-(phenylcarbamoyl)pyridin-2-yl]sulfanyl}acetate|ethyl {[5-(anilinocarbonyl)-3-cyano-4-(4-methoxyphenyl)-6-methyl-2-pyridinyl]sulfanyl}acetate|ETHYL 2-{[3-CYANO-4-(4-METHOXYPHENYL)-6-METHYL-5-(PHENYLCARBAMOYL)PYRIDIN-2-YL]SULFANYL}ACETATE
| Molecular Formula | C25H23N3O4S |
|---|---|
| Molecular Weight | 461.14093 g/mol |
| LogP | 4.8448 |
| Topological Polar Surface Area | 101.31 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 8 |
| Exact Mass | 461.14093 |
| Monoisotopic Mass | 461.14093 |
| Heavy Atoms | 33 |
| Complexity | 1189.0142 |
Chemical Identifiers
| CAS Number | 201281-13-2 |
|---|---|
| SMILES | CCOC(=O)CSC1=NC(=C(C(=C1C#N)C2=CC=C(C=C2)OC)C(=O)NC3=CC=CC=C3)C |
Product Overview
ChemDiv1_010833 (CAS 201281-13-2), with molecular formula C25H23N3O4S and molecular weight 461.14093 g/mol. IUPAC: ethyl 2-[[3-cyano-4-(4-methoxyphenyl)-6-methyl-5-(phenylcarbamoyl)-2-pyridinyl]sulfanyl]acetate.