2-[4-(quinolin-5-yl)-5-sulfanyl-4H-1,2,4-triazol-3-yl]phenol
Chemical Structure Depiction of
2-[4-(quinolin-5-yl)-5-sulfanyl-4H-1,2,4-triazol-3-yl]phenol
2-[4-(quinolin-5-yl)-5-sulfanyl-4H-1,2,4-triazol-3-yl]phenol
Compound characteristics
| Compound ID: | 8019-9502 |
| Compound Name: | 2-[4-(quinolin-5-yl)-5-sulfanyl-4H-1,2,4-triazol-3-yl]phenol |
| Molecular Weight: | 320.37 |
| Molecular Formula: | C17 H12 N4 O S |
| Smiles: | c1ccc(c(c1)c1nnc(n1c1cccc2c1cccn2)S)O |
| Stereo: | ACHIRAL |
| logP: | 3.4151 |
| logD: | 2.0491 |
| logSw: | -3.1191 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 48.468 |
| InChI Key: | QHLCVVLXLWWHND-UHFFFAOYSA-N |