2-(adamantan-1-yl)-4-chloro-5-{[2-(4-chlorophenyl)ethyl]amino}pyridazin-3(2H)-one
Chemical Structure Depiction of
2-(adamantan-1-yl)-4-chloro-5-{[2-(4-chlorophenyl)ethyl]amino}pyridazin-3(2H)-one
2-(adamantan-1-yl)-4-chloro-5-{[2-(4-chlorophenyl)ethyl]amino}pyridazin-3(2H)-one
Compound characteristics
| Compound ID: | C301-1405 |
| Compound Name: | 2-(adamantan-1-yl)-4-chloro-5-{[2-(4-chlorophenyl)ethyl]amino}pyridazin-3(2H)-one |
| Molecular Weight: | 418.37 |
| Molecular Formula: | C22 H25 Cl2 N3 O |
| Smiles: | C(CNC1C=NN(C(C=1[Cl])=O)C12CC3CC(CC(C3)C2)C1)c1ccc(cc1)[Cl] |
| Stereo: | ACHIRAL |
| logP: | 5.0983 |
| logD: | 5.0983 |
| logSw: | -5.5256 |
| Hydrogen bond acceptors count: | 3 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 36.659 |
| InChI Key: | YMBUZUNAUOBWKX-UHFFFAOYSA-N |