N-benzyl-N-(2-{4-[6-(3,4-dimethoxyphenyl)pyridazin-3-yl]-1,4-diazepan-1-yl}-2-oxoethyl)-2-methylbenzamide
Chemical Structure Depiction of
N-benzyl-N-(2-{4-[6-(3,4-dimethoxyphenyl)pyridazin-3-yl]-1,4-diazepan-1-yl}-2-oxoethyl)-2-methylbenzamide
N-benzyl-N-(2-{4-[6-(3,4-dimethoxyphenyl)pyridazin-3-yl]-1,4-diazepan-1-yl}-2-oxoethyl)-2-methylbenzamide
Compound characteristics
| Compound ID: | V023-1096 |
| Compound Name: | N-benzyl-N-(2-{4-[6-(3,4-dimethoxyphenyl)pyridazin-3-yl]-1,4-diazepan-1-yl}-2-oxoethyl)-2-methylbenzamide |
| Molecular Weight: | 579.7 |
| Molecular Formula: | C34 H37 N5 O4 |
| Salt: | not_available |
| Smiles: | Cc1ccccc1C(N(CC(N1CCCN(CC1)c1ccc(c2ccc(c(c2)OC)OC)nn1)=O)Cc1ccccc1)=O |
| Stereo: | ACHIRAL |
| logP: | 4.2159 |
| logD: | 4.1029 |
| logSw: | -4.2499 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 72.357 |
| InChI Key: | FDLQTCAFUBMERU-UHFFFAOYSA-N |