N-(2-chloro-4-methylphenyl)-2-[(6-methyl-7-oxo-3-phenyl-2-sulfanylidene-2,3,6,7-tetrahydro[1,3]thiazolo[4,5-d]pyrimidin-5-yl)sulfanyl]acetamide
Chemical Structure Depiction of
N-(2-chloro-4-methylphenyl)-2-[(6-methyl-7-oxo-3-phenyl-2-sulfanylidene-2,3,6,7-tetrahydro[1,3]thiazolo[4,5-d]pyrimidin-5-yl)sulfanyl]acetamide
N-(2-chloro-4-methylphenyl)-2-[(6-methyl-7-oxo-3-phenyl-2-sulfanylidene-2,3,6,7-tetrahydro[1,3]thiazolo[4,5-d]pyrimidin-5-yl)sulfanyl]acetamide
Compound characteristics
| Compound ID: | F143-0051 |
| Compound Name: | N-(2-chloro-4-methylphenyl)-2-[(6-methyl-7-oxo-3-phenyl-2-sulfanylidene-2,3,6,7-tetrahydro[1,3]thiazolo[4,5-d]pyrimidin-5-yl)sulfanyl]acetamide |
| Molecular Weight: | 489.04 |
| Molecular Formula: | C21 H17 Cl N4 O2 S3 |
| Smiles: | Cc1ccc(c(c1)[Cl])NC(CSC1=NC2=C(C(N1C)=O)SC(N2c1ccccc1)=S)=O |
| Stereo: | ACHIRAL |
| logP: | 4.1327 |
| logD: | 4.1326 |
| logSw: | -4.3337 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 50.055 |
| InChI Key: | WLSBTGKOPNITLR-UHFFFAOYSA-N |