N~1~-(12-oxo-6,7,8,9,10,12-hexahydroazepino[2,1-b]quinazolin-2-yl)-N~2~-(4-sulfamoylphenyl)ethanediamide
Chemical Structure Depiction of
N~1~-(12-oxo-6,7,8,9,10,12-hexahydroazepino[2,1-b]quinazolin-2-yl)-N~2~-(4-sulfamoylphenyl)ethanediamide
N~1~-(12-oxo-6,7,8,9,10,12-hexahydroazepino[2,1-b]quinazolin-2-yl)-N~2~-(4-sulfamoylphenyl)ethanediamide
Compound characteristics
| Compound ID: | C909-0194 |
| Compound Name: | N~1~-(12-oxo-6,7,8,9,10,12-hexahydroazepino[2,1-b]quinazolin-2-yl)-N~2~-(4-sulfamoylphenyl)ethanediamide |
| Molecular Weight: | 455.49 |
| Molecular Formula: | C21 H21 N5 O5 S |
| Smiles: | C1CCC2=Nc3ccc(cc3C(N2CC1)=O)NC(C(Nc1ccc(cc1)S(N)(=O)=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 0.7148 |
| logD: | 0.2444 |
| logSw: | -2.4135 |
| Hydrogen bond acceptors count: | 12 |
| Hydrogen bond donors count: | 4 |
| Polar surface area: | 123.777 |
| InChI Key: | HWBNTZNYIJEMJQ-UHFFFAOYSA-N |