2-methoxy-N-{rel-(3R,4R)-4-(3-methyl-1H-1,2,4-triazol-5-yl)-1-[(thiophen-3-yl)methyl]piperidin-3-yl}acetamide
Chemical Structure Depiction of
2-methoxy-N-{rel-(3R,4R)-4-(3-methyl-1H-1,2,4-triazol-5-yl)-1-[(thiophen-3-yl)methyl]piperidin-3-yl}acetamide
2-methoxy-N-{rel-(3R,4R)-4-(3-methyl-1H-1,2,4-triazol-5-yl)-1-[(thiophen-3-yl)methyl]piperidin-3-yl}acetamide
Compound characteristics
| Compound ID: | S620-2482 |
| Compound Name: | 2-methoxy-N-{rel-(3R,4R)-4-(3-methyl-1H-1,2,4-triazol-5-yl)-1-[(thiophen-3-yl)methyl]piperidin-3-yl}acetamide |
| Molecular Weight: | 349.45 |
| Molecular Formula: | C16 H23 N5 O2 S |
| Smiles: | Cc1nc([C@H]2CCN(Cc3ccsc3)C[C@H]2NC(COC)=O)[nH]n1 |
| Stereo: | RACEMIC MIXTURE (RELATIVE) |
| logP: | 0.4037 |
| logD: | -0.5309 |
| logSw: | -2.3443 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 71.139 |
| InChI Key: | SOISLTRVBUUXFH-KBPBESRZSA-N |