2-{[5-(furan-2-yl)-4-(4-methylphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}-N,N-di(propan-2-yl)acetamide
Chemical Structure Depiction of
2-{[5-(furan-2-yl)-4-(4-methylphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}-N,N-di(propan-2-yl)acetamide
2-{[5-(furan-2-yl)-4-(4-methylphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}-N,N-di(propan-2-yl)acetamide
Compound characteristics
| Compound ID: | V008-0079 |
| Compound Name: | 2-{[5-(furan-2-yl)-4-(4-methylphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}-N,N-di(propan-2-yl)acetamide |
| Molecular Weight: | 398.53 |
| Molecular Formula: | C21 H26 N4 O2 S |
| Salt: | not_available |
| Smiles: | CC(C)N(C(C)C)C(CSc1nnc(c2ccco2)n1c1ccc(C)cc1)=O |
| Stereo: | ACHIRAL |
| logP: | 3.9678 |
| logD: | 3.9678 |
| logSw: | -3.9139 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 49.113 |
| InChI Key: | ORDJQSYSQPPDCS-UHFFFAOYSA-N |