N,N-dimethyl-2-{[4-phenyl-5-(pyridin-3-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide
Chemical Structure Depiction of
N,N-dimethyl-2-{[4-phenyl-5-(pyridin-3-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide
N,N-dimethyl-2-{[4-phenyl-5-(pyridin-3-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide
Compound characteristics
| Compound ID: | 8014-2514 |
| Compound Name: | N,N-dimethyl-2-{[4-phenyl-5-(pyridin-3-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide |
| Molecular Weight: | 339.42 |
| Molecular Formula: | C17 H17 N5 O S |
| Smiles: | CN(C)C(CSc1nnc(c2cccnc2)n1c1ccccc1)=O |
| Stereo: | ACHIRAL |
| logP: | 1.2596 |
| logD: | 1.2554 |
| logSw: | -1.3991 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 49.975 |
| InChI Key: | WHBPYXFSIYJREP-UHFFFAOYSA-N |