N-benzyl-3-methyl-N-(2-{4-[6-(4-methylphenyl)pyridazin-3-yl]-1,4-diazepan-1-yl}-2-oxoethyl)butanamide
Chemical Structure Depiction of
N-benzyl-3-methyl-N-(2-{4-[6-(4-methylphenyl)pyridazin-3-yl]-1,4-diazepan-1-yl}-2-oxoethyl)butanamide
N-benzyl-3-methyl-N-(2-{4-[6-(4-methylphenyl)pyridazin-3-yl]-1,4-diazepan-1-yl}-2-oxoethyl)butanamide
Compound characteristics
| Compound ID: | V026-8424 |
| Compound Name: | N-benzyl-3-methyl-N-(2-{4-[6-(4-methylphenyl)pyridazin-3-yl]-1,4-diazepan-1-yl}-2-oxoethyl)butanamide |
| Molecular Weight: | 499.66 |
| Molecular Formula: | C30 H37 N5 O2 |
| Salt: | not_available |
| Smiles: | CC(C)CC(N(CC(N1CCCN(CC1)c1ccc(c2ccc(C)cc2)nn1)=O)Cc1ccccc1)=O |
| Stereo: | ACHIRAL |
| logP: | 4.7405 |
| logD: | 4.7073 |
| logSw: | -4.4253 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 56.841 |
| InChI Key: | YNLYWWGWONJBKB-UHFFFAOYSA-N |