N-butyl-N-(2-{4-[6-(2-chlorophenyl)pyridazin-3-yl]-1,4-diazepan-1-yl}-2-oxoethyl)-4-methoxybenzamide
Chemical Structure Depiction of
N-butyl-N-(2-{4-[6-(2-chlorophenyl)pyridazin-3-yl]-1,4-diazepan-1-yl}-2-oxoethyl)-4-methoxybenzamide
N-butyl-N-(2-{4-[6-(2-chlorophenyl)pyridazin-3-yl]-1,4-diazepan-1-yl}-2-oxoethyl)-4-methoxybenzamide
Compound characteristics
| Compound ID: | V009-2805 |
| Compound Name: | N-butyl-N-(2-{4-[6-(2-chlorophenyl)pyridazin-3-yl]-1,4-diazepan-1-yl}-2-oxoethyl)-4-methoxybenzamide |
| Molecular Weight: | 536.07 |
| Molecular Formula: | C29 H34 Cl N5 O3 |
| Salt: | not_available |
| Smiles: | CCCCN(CC(N1CCCN(CC1)c1ccc(c2ccccc2[Cl])nn1)=O)C(c1ccc(cc1)OC)=O |
| Stereo: | ACHIRAL |
| logP: | 4.5128 |
| logD: | 4.5066 |
| logSw: | -4.6381 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 64.89 |
| InChI Key: | NFMCJILAADKGNX-UHFFFAOYSA-N |