2-(adamantan-1-yl)-4-chloro-5-(4-methylpiperazin-1-yl)pyridazin-3(2H)-one
Chemical Structure Depiction of
2-(adamantan-1-yl)-4-chloro-5-(4-methylpiperazin-1-yl)pyridazin-3(2H)-one
2-(adamantan-1-yl)-4-chloro-5-(4-methylpiperazin-1-yl)pyridazin-3(2H)-one
Compound characteristics
| Compound ID: | C719-0072 |
| Compound Name: | 2-(adamantan-1-yl)-4-chloro-5-(4-methylpiperazin-1-yl)pyridazin-3(2H)-one |
| Molecular Weight: | 362.9 |
| Molecular Formula: | C19 H27 Cl N4 O |
| Smiles: | CN1CCN(CC1)C1C=NN(C(C=1[Cl])=O)C12CC3CC(CC(C3)C2)C1 |
| Stereo: | ACHIRAL |
| logP: | 3.199 |
| logD: | 3.1935 |
| logSw: | -3.4116 |
| Hydrogen bond acceptors count: | 4 |
| Polar surface area: | 34.156 |
| InChI Key: | XNXHPJOYUZOVSD-UHFFFAOYSA-N |