1-[(2-chloro-6-fluorophenyl)methyl]-N-{[4-(4-methylpiperazin-1-yl)phenyl]methyl}piperidine-4-carboxamide
Chemical Structure Depiction of
1-[(2-chloro-6-fluorophenyl)methyl]-N-{[4-(4-methylpiperazin-1-yl)phenyl]methyl}piperidine-4-carboxamide
1-[(2-chloro-6-fluorophenyl)methyl]-N-{[4-(4-methylpiperazin-1-yl)phenyl]methyl}piperidine-4-carboxamide
Compound characteristics
| Compound ID: | Y300-1401 |
| Compound Name: | 1-[(2-chloro-6-fluorophenyl)methyl]-N-{[4-(4-methylpiperazin-1-yl)phenyl]methyl}piperidine-4-carboxamide |
| Molecular Weight: | 459.01 |
| Molecular Formula: | C25 H32 Cl F N4 O |
| Smiles: | CN1CCN(CC1)c1ccc(CNC(C2CCN(CC2)Cc2c(cccc2[Cl])F)=O)cc1 |
| Stereo: | ACHIRAL |
| logP: | 3.0284 |
| logD: | 1.38 |
| logSw: | -3.4033 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 35.313 |
| InChI Key: | PFJGRRJJCQUYKG-UHFFFAOYSA-N |