3-(3,5-dimethoxyphenyl)-4-phenyl-5-[(prop-2-en-1-yl)sulfanyl]-4H-1,2,4-triazole
Chemical Structure Depiction of
3-(3,5-dimethoxyphenyl)-4-phenyl-5-[(prop-2-en-1-yl)sulfanyl]-4H-1,2,4-triazole
3-(3,5-dimethoxyphenyl)-4-phenyl-5-[(prop-2-en-1-yl)sulfanyl]-4H-1,2,4-triazole
Compound characteristics
| Compound ID: | V013-7745 |
| Compound Name: | 3-(3,5-dimethoxyphenyl)-4-phenyl-5-[(prop-2-en-1-yl)sulfanyl]-4H-1,2,4-triazole |
| Molecular Weight: | 353.44 |
| Molecular Formula: | C19 H19 N3 O2 S |
| Salt: | not_available |
| Smiles: | COc1cc(cc(c1)OC)c1nnc(n1c1ccccc1)SCC=C |
| Stereo: | ACHIRAL |
| logP: | 4.4104 |
| logD: | 4.4104 |
| logSw: | -4.4099 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 40.072 |
| InChI Key: | BCJWIPSIZBPABO-UHFFFAOYSA-N |