2-phenyl-6-{4-[(phenylsulfanyl)acetyl]-1,4-diazepan-1-yl}pyridazin-3(2H)-one
Chemical Structure Depiction of
2-phenyl-6-{4-[(phenylsulfanyl)acetyl]-1,4-diazepan-1-yl}pyridazin-3(2H)-one
2-phenyl-6-{4-[(phenylsulfanyl)acetyl]-1,4-diazepan-1-yl}pyridazin-3(2H)-one
Compound characteristics
| Compound ID: | F977-0571 |
| Compound Name: | 2-phenyl-6-{4-[(phenylsulfanyl)acetyl]-1,4-diazepan-1-yl}pyridazin-3(2H)-one |
| Molecular Weight: | 420.53 |
| Molecular Formula: | C23 H24 N4 O2 S |
| Smiles: | C1CN(CCN(C1)C(CSc1ccccc1)=O)C1C=CC(N(c2ccccc2)N=1)=O |
| Stereo: | ACHIRAL |
| logP: | 2.905 |
| logD: | 2.905 |
| logSw: | -3.3254 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 46.965 |
| InChI Key: | HUOJOUVNRKRESL-UHFFFAOYSA-N |