ethyl 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
ethyl 4-methyl-2-{2-[(4-oxo-3,4,5,6,7,8-hexahydroquinazolin-2-yl)sulfanyl]acetamido}-1,3-thiazole-5-carboxylate
ethyl 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: | D467-0092 |
Compound Name: | ethyl 4-methyl-2-{2-[(4-oxo-3,4,5,6,7,8-hexahydroquinazolin-2-yl)sulfanyl]acetamido}-1,3-thiazole-5-carboxylate |
Molecular Weight: | 408.5 |
Molecular Formula: | C17 H20 N4 O4 S2 |
Smiles: | CCOC(c1c(C)nc(NC(CSC2NC(C3CCCCC=3N=2)=O)=O)s1)=O |
Stereo: | ACHIRAL |
logP: | 2.2771 |
logD: | 2.0619 |
logSw: | -2.496 |
Hydrogen bond acceptors count: | 10 |
Hydrogen bond donors count: | 2 |
Polar surface area: | 88.998 |
InChI Key: | BBWFQNPXBSUOPG-UHFFFAOYSA-N |