N-[(4-fluorophenyl)methyl]-N-{2-oxo-2-[4-(6-phenylpyridazin-3-yl)-1,4-diazepan-1-yl]ethyl}cyclobutanecarboxamide
Chemical Structure Depiction of
N-[(4-fluorophenyl)methyl]-N-{2-oxo-2-[4-(6-phenylpyridazin-3-yl)-1,4-diazepan-1-yl]ethyl}cyclobutanecarboxamide
N-[(4-fluorophenyl)methyl]-N-{2-oxo-2-[4-(6-phenylpyridazin-3-yl)-1,4-diazepan-1-yl]ethyl}cyclobutanecarboxamide
Compound characteristics
| Compound ID: | V027-5396 |
| Compound Name: | N-[(4-fluorophenyl)methyl]-N-{2-oxo-2-[4-(6-phenylpyridazin-3-yl)-1,4-diazepan-1-yl]ethyl}cyclobutanecarboxamide |
| Molecular Weight: | 501.6 |
| Molecular Formula: | C29 H32 F N5 O2 |
| Salt: | not_available |
| Smiles: | C1CC(C1)C(N(CC(N1CCCN(CC1)c1ccc(c2ccccc2)nn1)=O)Cc1ccc(cc1)F)=O |
| Stereo: | ACHIRAL |
| logP: | 3.5444 |
| logD: | 3.5383 |
| logSw: | -3.37 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 57.62 |
| InChI Key: | DXGLDOCZNJCQJD-UHFFFAOYSA-N |