N-ethyl-N-(2-{4-[6-(4-methylphenyl)pyridazin-3-yl]-1,4-diazepan-1-yl}-2-oxoethyl)benzamide
Chemical Structure Depiction of
N-ethyl-N-(2-{4-[6-(4-methylphenyl)pyridazin-3-yl]-1,4-diazepan-1-yl}-2-oxoethyl)benzamide
N-ethyl-N-(2-{4-[6-(4-methylphenyl)pyridazin-3-yl]-1,4-diazepan-1-yl}-2-oxoethyl)benzamide
Compound characteristics
| Compound ID: | V001-7854 |
| Compound Name: | N-ethyl-N-(2-{4-[6-(4-methylphenyl)pyridazin-3-yl]-1,4-diazepan-1-yl}-2-oxoethyl)benzamide |
| Molecular Weight: | 457.58 |
| Molecular Formula: | C27 H31 N5 O2 |
| Salt: | not_available |
| Smiles: | CCN(CC(N1CCCN(CC1)c1ccc(c2ccc(C)cc2)nn1)=O)C(c1ccccc1)=O |
| Stereo: | ACHIRAL |
| logP: | 3.6088 |
| logD: | 3.5756 |
| logSw: | -3.4031 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 57.093 |
| InChI Key: | CWUZAPJJCNFEMD-UHFFFAOYSA-N |