methyl 4-methyl-2-{2-[(4-oxo-3,4,5,6,7,8-hexahydroquinazolin-2-yl)sulfanyl]acetamido}-1,3-thiazole-5-carboxylate
Chemical Structure Depiction of
methyl 4-methyl-2-{2-[(4-oxo-3,4,5,6,7,8-hexahydroquinazolin-2-yl)sulfanyl]acetamido}-1,3-thiazole-5-carboxylate
methyl 4-methyl-2-{2-[(4-oxo-3,4,5,6,7,8-hexahydroquinazolin-2-yl)sulfanyl]acetamido}-1,3-thiazole-5-carboxylate
Compound characteristics
| Compound ID: | D467-0089 |
| Compound Name: | methyl 4-methyl-2-{2-[(4-oxo-3,4,5,6,7,8-hexahydroquinazolin-2-yl)sulfanyl]acetamido}-1,3-thiazole-5-carboxylate |
| Molecular Weight: | 394.47 |
| Molecular Formula: | C16 H18 N4 O4 S2 |
| Smiles: | Cc1c(C(=O)OC)sc(NC(CSC2NC(C3CCCCC=3N=2)=O)=O)n1 |
| Stereo: | ACHIRAL |
| logP: | 1.8574 |
| logD: | 1.6422 |
| logSw: | -2.2823 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 89.418 |
| InChI Key: | RFLDCPYYLJHZIN-UHFFFAOYSA-N |