4-(1-phenylethyl)-5-(3,4,5-trimethoxyphenyl)-4H-1,2,4-triazole-3-thiol
Chemical Structure Depiction of
4-(1-phenylethyl)-5-(3,4,5-trimethoxyphenyl)-4H-1,2,4-triazole-3-thiol
4-(1-phenylethyl)-5-(3,4,5-trimethoxyphenyl)-4H-1,2,4-triazole-3-thiol
Compound characteristics
| Compound ID: | 8017-9724 |
| Compound Name: | 4-(1-phenylethyl)-5-(3,4,5-trimethoxyphenyl)-4H-1,2,4-triazole-3-thiol |
| Molecular Weight: | 371.46 |
| Molecular Formula: | C19 H21 N3 O3 S |
| Smiles: | CC(c1ccccc1)n1c(c2cc(c(c(c2)OC)OC)OC)nnc1S |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.3031 |
| logD: | 2.9587 |
| logSw: | -3.5032 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 46.388 |
| InChI Key: | IWGXJYYWUBCNBP-LBPRGKRZSA-N |