1-phenyl-2-{[4-phenyl-5-(thiophen-2-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}ethan-1-one
Chemical Structure Depiction of
1-phenyl-2-{[4-phenyl-5-(thiophen-2-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}ethan-1-one
1-phenyl-2-{[4-phenyl-5-(thiophen-2-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}ethan-1-one
Compound characteristics
| Compound ID: | G856-2620 |
| Compound Name: | 1-phenyl-2-{[4-phenyl-5-(thiophen-2-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}ethan-1-one |
| Molecular Weight: | 377.49 |
| Molecular Formula: | C20 H15 N3 O S2 |
| Smiles: | C(C(c1ccccc1)=O)Sc1nnc(c2cccs2)n1c1ccccc1 |
| Stereo: | ACHIRAL |
| logP: | 4.4085 |
| logD: | 4.4085 |
| logSw: | -4.4161 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 38.978 |
| InChI Key: | HXSCKPKBENPUGE-UHFFFAOYSA-N |