6-chloro-N-{1-[4-(1H-imidazol-1-yl)phenyl]ethyl}-2-oxo-2H-1-benzopyran-3-carboxamide
Chemical Structure Depiction of
6-chloro-N-{1-[4-(1H-imidazol-1-yl)phenyl]ethyl}-2-oxo-2H-1-benzopyran-3-carboxamide
6-chloro-N-{1-[4-(1H-imidazol-1-yl)phenyl]ethyl}-2-oxo-2H-1-benzopyran-3-carboxamide
Compound characteristics
| Compound ID: | 8017-8439 |
| Compound Name: | 6-chloro-N-{1-[4-(1H-imidazol-1-yl)phenyl]ethyl}-2-oxo-2H-1-benzopyran-3-carboxamide |
| Molecular Weight: | 393.83 |
| Molecular Formula: | C21 H16 Cl N3 O3 |
| Smiles: | CC(c1ccc(cc1)n1ccnc1)NC(C1=Cc2cc(ccc2OC1=O)[Cl])=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.0144 |
| logD: | 2.989 |
| logSw: | -3.9785 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 57.462 |
| InChI Key: | JHLPBFOWDHHRBC-ZDUSSCGKSA-N |