N-(5-chloro-2-hydroxyphenyl)-2-[(4-oxo-3,4,5,6,7,8-hexahydroquinazolin-2-yl)sulfanyl]acetamide
Chemical Structure Depiction of
N-(5-chloro-2-hydroxyphenyl)-2-[(4-oxo-3,4,5,6,7,8-hexahydroquinazolin-2-yl)sulfanyl]acetamide
N-(5-chloro-2-hydroxyphenyl)-2-[(4-oxo-3,4,5,6,7,8-hexahydroquinazolin-2-yl)sulfanyl]acetamide
Compound characteristics
| Compound ID: | D365-0129 |
| Compound Name: | N-(5-chloro-2-hydroxyphenyl)-2-[(4-oxo-3,4,5,6,7,8-hexahydroquinazolin-2-yl)sulfanyl]acetamide |
| Molecular Weight: | 365.84 |
| Molecular Formula: | C16 H16 Cl N3 O3 S |
| Smiles: | C1CCC2=C(C1)C(NC(=N2)SCC(Nc1cc(ccc1O)[Cl])=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.2142 |
| logD: | 1.999 |
| logSw: | -3.1023 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 73.471 |
| InChI Key: | YZZSFBULKQZHLT-UHFFFAOYSA-N |