2-(adamantan-1-yl)-4-chloro-5-{[(2-chloro-4-fluorophenyl)methyl]amino}pyridazin-3(2H)-one
Chemical Structure Depiction of
2-(adamantan-1-yl)-4-chloro-5-{[(2-chloro-4-fluorophenyl)methyl]amino}pyridazin-3(2H)-one
2-(adamantan-1-yl)-4-chloro-5-{[(2-chloro-4-fluorophenyl)methyl]amino}pyridazin-3(2H)-one
Compound characteristics
| Compound ID: | C301-1547 |
| Compound Name: | 2-(adamantan-1-yl)-4-chloro-5-{[(2-chloro-4-fluorophenyl)methyl]amino}pyridazin-3(2H)-one |
| Molecular Weight: | 422.33 |
| Molecular Formula: | C21 H22 Cl2 F N3 O |
| Smiles: | C1C2CC3CC1CC(C2)(C3)N1C(C(=C(C=N1)NCc1ccc(cc1[Cl])F)[Cl])=O |
| Stereo: | ACHIRAL |
| logP: | 5.3924 |
| logD: | 5.3924 |
| logSw: | -5.9937 |
| Hydrogen bond acceptors count: | 3 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 36.818 |
| InChI Key: | UUHJVMAMHRVLAD-UHFFFAOYSA-N |