N-[3-(methylsulfanyl)phenyl]-2-[(4-oxo-3,4,5,6,7,8-hexahydroquinazolin-2-yl)sulfanyl]acetamide
Chemical Structure Depiction of
N-[3-(methylsulfanyl)phenyl]-2-[(4-oxo-3,4,5,6,7,8-hexahydroquinazolin-2-yl)sulfanyl]acetamide
N-[3-(methylsulfanyl)phenyl]-2-[(4-oxo-3,4,5,6,7,8-hexahydroquinazolin-2-yl)sulfanyl]acetamide
Compound characteristics
| Compound ID: | C700-1256 |
| Compound Name: | N-[3-(methylsulfanyl)phenyl]-2-[(4-oxo-3,4,5,6,7,8-hexahydroquinazolin-2-yl)sulfanyl]acetamide |
| Molecular Weight: | 361.48 |
| Molecular Formula: | C17 H19 N3 O2 S2 |
| Smiles: | CSc1cccc(c1)NC(CSC1NC(C2CCCCC=2N=1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.6185 |
| logD: | 2.4033 |
| logSw: | -3.034 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 57.621 |
| InChI Key: | IIBWKDJHDJDYSB-UHFFFAOYSA-N |