2-(adamantan-1-yl)-4-chloro-5-{[2-(cyclohex-1-en-1-yl)ethyl]amino}pyridazin-3(2H)-one
Chemical Structure Depiction of
2-(adamantan-1-yl)-4-chloro-5-{[2-(cyclohex-1-en-1-yl)ethyl]amino}pyridazin-3(2H)-one
2-(adamantan-1-yl)-4-chloro-5-{[2-(cyclohex-1-en-1-yl)ethyl]amino}pyridazin-3(2H)-one
Compound characteristics
| Compound ID: | C719-0168 |
| Compound Name: | 2-(adamantan-1-yl)-4-chloro-5-{[2-(cyclohex-1-en-1-yl)ethyl]amino}pyridazin-3(2H)-one |
| Molecular Weight: | 387.95 |
| Molecular Formula: | C22 H30 Cl N3 O |
| Smiles: | C1CCC(CCNC2C=NN(C(C=2[Cl])=O)C23CC4CC(CC(C4)C3)C2)=CC1 |
| Stereo: | ACHIRAL |
| logP: | 4.874 |
| logD: | 4.874 |
| logSw: | -4.9083 |
| Hydrogen bond acceptors count: | 3 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 36.851 |
| InChI Key: | JGQDXFVOGFMTCS-UHFFFAOYSA-N |