2-(4-chloro-3,5-dimethylphenoxy)-N-{[1-(4-methylpiperazin-1-yl)cyclohexyl]methyl}acetamide--hydrogen chloride (1/1)
Chemical Structure Depiction of
2-(4-chloro-3,5-dimethylphenoxy)-N-{[1-(4-methylpiperazin-1-yl)cyclohexyl]methyl}acetamide--hydrogen chloride (1/1)
2-(4-chloro-3,5-dimethylphenoxy)-N-{[1-(4-methylpiperazin-1-yl)cyclohexyl]methyl}acetamide--hydrogen chloride (1/1)
Compound characteristics
| Compound ID: | D335-0743 |
| Compound Name: | 2-(4-chloro-3,5-dimethylphenoxy)-N-{[1-(4-methylpiperazin-1-yl)cyclohexyl]methyl}acetamide--hydrogen chloride (1/1) |
| Molecular Weight: | 444.44 |
| Molecular Formula: | C22 H34 Cl N3 O2 |
| Salt: | HCl |
| Smiles: | Cc1cc(cc(C)c1[Cl])OCC(NCC1(CCCCC1)N1CCN(C)CC1)=O |
| Stereo: | ACHIRAL |
| logP: | 4.2912 |
| logD: | 3.8697 |
| logSw: | -4.6389 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 38.647 |
| InChI Key: | FKNPUTFWWVCFOZ-UHFFFAOYSA-N |