N-butyl-N-(2-{4-[6-(4-fluorophenyl)pyridazin-3-yl]-1,4-diazepan-1-yl}-2-oxoethyl)benzamide
Chemical Structure Depiction of
N-butyl-N-(2-{4-[6-(4-fluorophenyl)pyridazin-3-yl]-1,4-diazepan-1-yl}-2-oxoethyl)benzamide
N-butyl-N-(2-{4-[6-(4-fluorophenyl)pyridazin-3-yl]-1,4-diazepan-1-yl}-2-oxoethyl)benzamide
Compound characteristics
| Compound ID: | V008-2513 |
| Compound Name: | N-butyl-N-(2-{4-[6-(4-fluorophenyl)pyridazin-3-yl]-1,4-diazepan-1-yl}-2-oxoethyl)benzamide |
| Molecular Weight: | 489.59 |
| Molecular Formula: | C28 H32 F N5 O2 |
| Smiles: | CCCCN(CC(N1CCCN(CC1)c1ccc(c2ccc(cc2)F)nn1)=O)C(c1ccccc1)=O |
| Stereo: | ACHIRAL |
| logP: | 4.1995 |
| logD: | 4.1976 |
| logSw: | -3.905 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 57.347 |
| InChI Key: | CAHKNBKLVMZZKR-UHFFFAOYSA-N |