N-ethyl-4-fluoro-N-{2-oxo-2-[4-(6-phenylpyridazin-3-yl)-1,4-diazepan-1-yl]ethyl}benzamide
Chemical Structure Depiction of
N-ethyl-4-fluoro-N-{2-oxo-2-[4-(6-phenylpyridazin-3-yl)-1,4-diazepan-1-yl]ethyl}benzamide
N-ethyl-4-fluoro-N-{2-oxo-2-[4-(6-phenylpyridazin-3-yl)-1,4-diazepan-1-yl]ethyl}benzamide
Compound characteristics
| Compound ID: | V025-9951 |
| Compound Name: | N-ethyl-4-fluoro-N-{2-oxo-2-[4-(6-phenylpyridazin-3-yl)-1,4-diazepan-1-yl]ethyl}benzamide |
| Molecular Weight: | 461.54 |
| Molecular Formula: | C26 H28 F N5 O2 |
| Smiles: | CCN(CC(N1CCCN(CC1)c1ccc(c2ccccc2)nn1)=O)C(c1ccc(cc1)F)=O |
| Stereo: | ACHIRAL |
| logP: | 3.2145 |
| logD: | 3.2084 |
| logSw: | -3.1771 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 57.093 |
| InChI Key: | GKPYKOUEAVJPAU-UHFFFAOYSA-N |