N-(2H-1,3-benzodioxol-5-yl)-2-[(2-oxo-1,2,5,6,7,8-hexahydroquinazolin-4-yl)sulfanyl]acetamide
Chemical Structure Depiction of
N-(2H-1,3-benzodioxol-5-yl)-2-[(2-oxo-1,2,5,6,7,8-hexahydroquinazolin-4-yl)sulfanyl]acetamide
N-(2H-1,3-benzodioxol-5-yl)-2-[(2-oxo-1,2,5,6,7,8-hexahydroquinazolin-4-yl)sulfanyl]acetamide
Compound characteristics
| Compound ID: | G857-0068 |
| Compound Name: | N-(2H-1,3-benzodioxol-5-yl)-2-[(2-oxo-1,2,5,6,7,8-hexahydroquinazolin-4-yl)sulfanyl]acetamide |
| Molecular Weight: | 359.4 |
| Molecular Formula: | C17 H17 N3 O4 S |
| Smiles: | C1CCC2=C(C1)C(=NC(N2)=O)SCC(Nc1ccc2c(c1)OCO2)=O |
| Stereo: | ACHIRAL |
| logP: | 2.1959 |
| logD: | 2.1666 |
| logSw: | -2.8617 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 72.656 |
| InChI Key: | CYRSTQQJWJNGPN-UHFFFAOYSA-N |