N-{rel-(3R,4R)-4-(3-methyl-1H-1,2,4-triazol-5-yl)-1-[(2,4,5-trifluorophenyl)methyl]piperidin-3-yl}cyclopropanecarboxamide
Chemical Structure Depiction of
N-{rel-(3R,4R)-4-(3-methyl-1H-1,2,4-triazol-5-yl)-1-[(2,4,5-trifluorophenyl)methyl]piperidin-3-yl}cyclopropanecarboxamide
N-{rel-(3R,4R)-4-(3-methyl-1H-1,2,4-triazol-5-yl)-1-[(2,4,5-trifluorophenyl)methyl]piperidin-3-yl}cyclopropanecarboxamide
Compound characteristics
| Compound ID: | S620-1815 |
| Compound Name: | N-{rel-(3R,4R)-4-(3-methyl-1H-1,2,4-triazol-5-yl)-1-[(2,4,5-trifluorophenyl)methyl]piperidin-3-yl}cyclopropanecarboxamide |
| Molecular Weight: | 393.41 |
| Molecular Formula: | C19 H22 F3 N5 O |
| Smiles: | Cc1nc([C@H]2CCN(Cc3cc(c(cc3F)F)F)C[C@H]2NC(C2CC2)=O)[nH]n1 |
| Stereo: | RACEMIC MIXTURE (RELATIVE) |
| logP: | 2.1831 |
| logD: | 2.144 |
| logSw: | -2.6868 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 62.162 |
| InChI Key: | ASFUFRCFCNZFGV-SUMWQHHRSA-N |