5-(2,3-dimethyl-1H-indol-5-yl)-4-(3,4-dimethylphenyl)-2,4-dihydro-3H-1,2,4-triazole-3-thione
Chemical Structure Depiction of
5-(2,3-dimethyl-1H-indol-5-yl)-4-(3,4-dimethylphenyl)-2,4-dihydro-3H-1,2,4-triazole-3-thione
5-(2,3-dimethyl-1H-indol-5-yl)-4-(3,4-dimethylphenyl)-2,4-dihydro-3H-1,2,4-triazole-3-thione
Compound characteristics
| Compound ID: | K822-0036 |
| Compound Name: | 5-(2,3-dimethyl-1H-indol-5-yl)-4-(3,4-dimethylphenyl)-2,4-dihydro-3H-1,2,4-triazole-3-thione |
| Molecular Weight: | 348.47 |
| Molecular Formula: | C20 H20 N4 S |
| Smiles: | Cc1ccc(cc1C)N1C(c2ccc3c(c2)c(C)c(C)[nH]3)=NNC1=S |
| Stereo: | ACHIRAL |
| logP: | 5.4243 |
| logD: | 4.6411 |
| logSw: | -5.7019 |
| Hydrogen bond acceptors count: | 3 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 36.899 |
| InChI Key: | BDHMHOJBUXPCKT-UHFFFAOYSA-N |