N-[(3-chlorophenyl)methyl]-4-{3-[(4-methylphenyl)sulfanyl]-6-oxopyridazin-1(6H)-yl}benzamide
Chemical Structure Depiction of
N-[(3-chlorophenyl)methyl]-4-{3-[(4-methylphenyl)sulfanyl]-6-oxopyridazin-1(6H)-yl}benzamide
N-[(3-chlorophenyl)methyl]-4-{3-[(4-methylphenyl)sulfanyl]-6-oxopyridazin-1(6H)-yl}benzamide
Compound characteristics
| Compound ID: | F616-0640 |
| Compound Name: | N-[(3-chlorophenyl)methyl]-4-{3-[(4-methylphenyl)sulfanyl]-6-oxopyridazin-1(6H)-yl}benzamide |
| Molecular Weight: | 461.97 |
| Molecular Formula: | C25 H20 Cl N3 O2 S |
| Smiles: | Cc1ccc(cc1)SC1C=CC(N(c2ccc(cc2)C(NCc2cccc(c2)[Cl])=O)N=1)=O |
| Stereo: | ACHIRAL |
| logP: | 5.4093 |
| logD: | 5.4092 |
| logSw: | -5.9279 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 51.961 |
| InChI Key: | CQVSVVPJIKGKPN-UHFFFAOYSA-N |