N-{rel-(3R,4R)-4-(3-methyl-1H-1,2,4-triazol-5-yl)-1-[(thiophen-2-yl)methyl]piperidin-3-yl}cyclopropanecarboxamide
Chemical Structure Depiction of
N-{rel-(3R,4R)-4-(3-methyl-1H-1,2,4-triazol-5-yl)-1-[(thiophen-2-yl)methyl]piperidin-3-yl}cyclopropanecarboxamide
N-{rel-(3R,4R)-4-(3-methyl-1H-1,2,4-triazol-5-yl)-1-[(thiophen-2-yl)methyl]piperidin-3-yl}cyclopropanecarboxamide
Compound characteristics
| Compound ID: | S620-1848 |
| Compound Name: | N-{rel-(3R,4R)-4-(3-methyl-1H-1,2,4-triazol-5-yl)-1-[(thiophen-2-yl)methyl]piperidin-3-yl}cyclopropanecarboxamide |
| Molecular Weight: | 345.46 |
| Molecular Formula: | C17 H23 N5 O S |
| Smiles: | Cc1nc([C@H]2CCN(Cc3cccs3)C[C@H]2NC(C2CC2)=O)[nH]n1 |
| Stereo: | RACEMIC MIXTURE (RELATIVE) |
| logP: | 1.4866 |
| logD: | 1.2602 |
| logSw: | -2.5521 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 63.18 |
| InChI Key: | OALPWLJMIFWUKD-GJZGRUSLSA-N |