2-{[4-phenyl-5-(thiophen-2-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}-N-(quinolin-4-yl)acetamide
Chemical Structure Depiction of
2-{[4-phenyl-5-(thiophen-2-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}-N-(quinolin-4-yl)acetamide
2-{[4-phenyl-5-(thiophen-2-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}-N-(quinolin-4-yl)acetamide
Compound characteristics
| Compound ID: | 8015-6604 |
| Compound Name: | 2-{[4-phenyl-5-(thiophen-2-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}-N-(quinolin-4-yl)acetamide |
| Molecular Weight: | 443.55 |
| Molecular Formula: | C23 H17 N5 O S2 |
| Smiles: | C(C(Nc1ccnc2ccccc12)=O)Sc1nnc(c2cccs2)n1c1ccccc1 |
| Stereo: | ACHIRAL |
| logP: | 4.1581 |
| logD: | 4.1488 |
| logSw: | -4.3358 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 56.945 |
| InChI Key: | BPQGMNVCNIPBMC-UHFFFAOYSA-N |