2-(3,4-dimethylphenyl)-6-[4-(3-methylbenzoyl)-1,4-diazepan-1-yl]pyridazin-3(2H)-one
Chemical Structure Depiction of
2-(3,4-dimethylphenyl)-6-[4-(3-methylbenzoyl)-1,4-diazepan-1-yl]pyridazin-3(2H)-one
2-(3,4-dimethylphenyl)-6-[4-(3-methylbenzoyl)-1,4-diazepan-1-yl]pyridazin-3(2H)-one
Compound characteristics
| Compound ID: | F977-0339 |
| Compound Name: | 2-(3,4-dimethylphenyl)-6-[4-(3-methylbenzoyl)-1,4-diazepan-1-yl]pyridazin-3(2H)-one |
| Molecular Weight: | 416.52 |
| Molecular Formula: | C25 H28 N4 O2 |
| Smiles: | Cc1cccc(c1)C(N1CCCN(CC1)C1C=CC(N(c2ccc(C)c(C)c2)N=1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.9679 |
| logD: | 3.9679 |
| logSw: | -4.02 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 47.492 |
| InChI Key: | MHYPJPIYDFMYLL-UHFFFAOYSA-N |