4-fluoro-N-{2-oxo-2-[4-(6-phenylpyridazin-3-yl)-1,4-diazepan-1-yl]ethyl}-N-(prop-2-en-1-yl)benzamide
Chemical Structure Depiction of
4-fluoro-N-{2-oxo-2-[4-(6-phenylpyridazin-3-yl)-1,4-diazepan-1-yl]ethyl}-N-(prop-2-en-1-yl)benzamide
4-fluoro-N-{2-oxo-2-[4-(6-phenylpyridazin-3-yl)-1,4-diazepan-1-yl]ethyl}-N-(prop-2-en-1-yl)benzamide
Compound characteristics
| Compound ID: | V017-8364 |
| Compound Name: | 4-fluoro-N-{2-oxo-2-[4-(6-phenylpyridazin-3-yl)-1,4-diazepan-1-yl]ethyl}-N-(prop-2-en-1-yl)benzamide |
| Molecular Weight: | 473.55 |
| Molecular Formula: | C27 H28 F N5 O2 |
| Salt: | not_available |
| Smiles: | C=CCN(CC(N1CCCN(CC1)c1ccc(c2ccccc2)nn1)=O)C(c1ccc(cc1)F)=O |
| Stereo: | ACHIRAL |
| logP: | 3.4211 |
| logD: | 3.415 |
| logSw: | -3.4823 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 57.347 |
| InChI Key: | NFIUYFQAESJAKG-UHFFFAOYSA-N |