N-[2-(3,4-dimethoxyphenyl)ethyl]-2-[(4-oxo-3,4,5,6,7,8-hexahydroquinazolin-2-yl)sulfanyl]acetamide
Chemical Structure Depiction of
N-[2-(3,4-dimethoxyphenyl)ethyl]-2-[(4-oxo-3,4,5,6,7,8-hexahydroquinazolin-2-yl)sulfanyl]acetamide
N-[2-(3,4-dimethoxyphenyl)ethyl]-2-[(4-oxo-3,4,5,6,7,8-hexahydroquinazolin-2-yl)sulfanyl]acetamide
Compound characteristics
| Compound ID: | D365-0075 |
| Compound Name: | N-[2-(3,4-dimethoxyphenyl)ethyl]-2-[(4-oxo-3,4,5,6,7,8-hexahydroquinazolin-2-yl)sulfanyl]acetamide |
| Molecular Weight: | 403.5 |
| Molecular Formula: | C20 H25 N3 O4 S |
| Smiles: | COc1ccc(CCNC(CSC2NC(C3CCCCC=3N=2)=O)=O)cc1OC |
| Stereo: | ACHIRAL |
| logP: | 1.1307 |
| logD: | 0.9154 |
| logSw: | -2.3513 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 74.046 |
| InChI Key: | OWWSLKLVWQNQBU-UHFFFAOYSA-N |