1-(6-{[2-(3-chloro-4-methylanilino)-2-oxoethyl]sulfanyl}pyridazin-3-yl)-N-(propan-2-yl)piperidine-4-carboxamide
Chemical Structure Depiction of
1-(6-{[2-(3-chloro-4-methylanilino)-2-oxoethyl]sulfanyl}pyridazin-3-yl)-N-(propan-2-yl)piperidine-4-carboxamide
1-(6-{[2-(3-chloro-4-methylanilino)-2-oxoethyl]sulfanyl}pyridazin-3-yl)-N-(propan-2-yl)piperidine-4-carboxamide
Compound characteristics
| Compound ID: | L381-0916 |
| Compound Name: | 1-(6-{[2-(3-chloro-4-methylanilino)-2-oxoethyl]sulfanyl}pyridazin-3-yl)-N-(propan-2-yl)piperidine-4-carboxamide |
| Molecular Weight: | 462.01 |
| Molecular Formula: | C22 H28 Cl N5 O2 S |
| Smiles: | CC(C)NC(C1CCN(CC1)c1ccc(nn1)SCC(Nc1ccc(C)c(c1)[Cl])=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.119 |
| logD: | 4.1187 |
| logSw: | -4.3608 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 70.795 |
| InChI Key: | HKFLZGULXRHCPT-UHFFFAOYSA-N |