N-[4-(diethylsulfamoyl)phenyl]-12-oxo-6,7,8,9,10,12-hexahydroazepino[2,1-b]quinazoline-3-carboxamide
Chemical Structure Depiction of
N-[4-(diethylsulfamoyl)phenyl]-12-oxo-6,7,8,9,10,12-hexahydroazepino[2,1-b]quinazoline-3-carboxamide
N-[4-(diethylsulfamoyl)phenyl]-12-oxo-6,7,8,9,10,12-hexahydroazepino[2,1-b]quinazoline-3-carboxamide
Compound characteristics
| Compound ID: | C849-0620 |
| Compound Name: | N-[4-(diethylsulfamoyl)phenyl]-12-oxo-6,7,8,9,10,12-hexahydroazepino[2,1-b]quinazoline-3-carboxamide |
| Molecular Weight: | 468.57 |
| Molecular Formula: | C24 H28 N4 O4 S |
| Smiles: | CCN(CC)S(c1ccc(cc1)NC(c1ccc2C(N3CCCCCC3=Nc2c1)=O)=O)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.7062 |
| logD: | 2.6731 |
| logSw: | -3.5553 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 80.907 |
| InChI Key: | ZZNIXQITYXSSPA-UHFFFAOYSA-N |