1-{[1-(3-chloro-4-fluorobenzoyl)-4-hydroxypiperidin-4-yl]methyl}-N-cyclopentyl-1H-1,2,3-triazole-4-carboxamide
Chemical Structure Depiction of
1-{[1-(3-chloro-4-fluorobenzoyl)-4-hydroxypiperidin-4-yl]methyl}-N-cyclopentyl-1H-1,2,3-triazole-4-carboxamide
1-{[1-(3-chloro-4-fluorobenzoyl)-4-hydroxypiperidin-4-yl]methyl}-N-cyclopentyl-1H-1,2,3-triazole-4-carboxamide
Compound characteristics
| Compound ID: | SB11-0456 |
| Compound Name: | 1-{[1-(3-chloro-4-fluorobenzoyl)-4-hydroxypiperidin-4-yl]methyl}-N-cyclopentyl-1H-1,2,3-triazole-4-carboxamide |
| Molecular Weight: | 449.91 |
| Molecular Formula: | C21 H25 Cl F N5 O3 |
| Smiles: | C1CCC(C1)NC(c1cn(CC2(CCN(CC2)C(c2ccc(c(c2)[Cl])F)=O)O)nn1)=O |
| Stereo: | ACHIRAL |
| logP: | 1.482 |
| logD: | 1.482 |
| logSw: | -2.7944 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 83.478 |
| InChI Key: | ONDFTPHJLRPJGH-UHFFFAOYSA-N |