2-(adamantan-1-yl)-4-chloro-5-[4-(2,3-dimethylphenyl)piperazin-1-yl]pyridazin-3(2H)-one
Chemical Structure Depiction of
2-(adamantan-1-yl)-4-chloro-5-[4-(2,3-dimethylphenyl)piperazin-1-yl]pyridazin-3(2H)-one
2-(adamantan-1-yl)-4-chloro-5-[4-(2,3-dimethylphenyl)piperazin-1-yl]pyridazin-3(2H)-one
Compound characteristics
| Compound ID: | C719-0078 |
| Compound Name: | 2-(adamantan-1-yl)-4-chloro-5-[4-(2,3-dimethylphenyl)piperazin-1-yl]pyridazin-3(2H)-one |
| Molecular Weight: | 453.03 |
| Molecular Formula: | C26 H33 Cl N4 O |
| Smiles: | Cc1cccc(c1C)N1CCN(CC1)C1C=NN(C(C=1[Cl])=O)C12CC3CC(CC(C3)C2)C1 |
| Stereo: | ACHIRAL |
| logP: | 6.1398 |
| logD: | 6.1398 |
| logSw: | -6.1649 |
| Hydrogen bond acceptors count: | 3 |
| Polar surface area: | 33.639 |
| InChI Key: | RGWYFCHJDSHADH-UHFFFAOYSA-N |