1-({[5-(2-methylfuran-3-yl)-4-phenyl-4H-1,2,4-triazol-3-yl]sulfanyl}acetyl)piperidine-4-carboxamide
Chemical Structure Depiction of
1-({[5-(2-methylfuran-3-yl)-4-phenyl-4H-1,2,4-triazol-3-yl]sulfanyl}acetyl)piperidine-4-carboxamide
1-({[5-(2-methylfuran-3-yl)-4-phenyl-4H-1,2,4-triazol-3-yl]sulfanyl}acetyl)piperidine-4-carboxamide
Compound characteristics
| Compound ID: | 8018-9488 |
| Compound Name: | 1-({[5-(2-methylfuran-3-yl)-4-phenyl-4H-1,2,4-triazol-3-yl]sulfanyl}acetyl)piperidine-4-carboxamide |
| Molecular Weight: | 425.51 |
| Molecular Formula: | C21 H23 N5 O3 S |
| Smiles: | Cc1c(cco1)c1nnc(n1c1ccccc1)SCC(N1CCC(CC1)C(N)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 1.4879 |
| logD: | 1.4878 |
| logSw: | -2.3536 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 83.397 |
| InChI Key: | JFUQAANPBLGXNO-UHFFFAOYSA-N |