N-(9-ethyl-9H-carbazol-3-yl)-12-oxo-6,7,8,9,10,12-hexahydroazepino[2,1-b]quinazoline-3-carboxamide
Chemical Structure Depiction of
N-(9-ethyl-9H-carbazol-3-yl)-12-oxo-6,7,8,9,10,12-hexahydroazepino[2,1-b]quinazoline-3-carboxamide
N-(9-ethyl-9H-carbazol-3-yl)-12-oxo-6,7,8,9,10,12-hexahydroazepino[2,1-b]quinazoline-3-carboxamide
Compound characteristics
| Compound ID: | C849-0524 |
| Compound Name: | N-(9-ethyl-9H-carbazol-3-yl)-12-oxo-6,7,8,9,10,12-hexahydroazepino[2,1-b]quinazoline-3-carboxamide |
| Molecular Weight: | 450.54 |
| Molecular Formula: | C28 H26 N4 O2 |
| Smiles: | CCn1c2ccccc2c2cc(ccc12)NC(c1ccc2C(N3CCCCCC3=Nc2c1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 5.0919 |
| logD: | 5.0919 |
| logSw: | -4.8558 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 50.511 |
| InChI Key: | NMOQCZRUOIHUAY-UHFFFAOYSA-N |