4-(3-chloro-2-methylphenyl)-5-(2,3-dimethyl-1H-indol-5-yl)-2,4-dihydro-3H-1,2,4-triazole-3-thione
Chemical Structure Depiction of
4-(3-chloro-2-methylphenyl)-5-(2,3-dimethyl-1H-indol-5-yl)-2,4-dihydro-3H-1,2,4-triazole-3-thione
4-(3-chloro-2-methylphenyl)-5-(2,3-dimethyl-1H-indol-5-yl)-2,4-dihydro-3H-1,2,4-triazole-3-thione
Compound characteristics
| Compound ID: | K822-0035 |
| Compound Name: | 4-(3-chloro-2-methylphenyl)-5-(2,3-dimethyl-1H-indol-5-yl)-2,4-dihydro-3H-1,2,4-triazole-3-thione |
| Molecular Weight: | 368.89 |
| Molecular Formula: | C19 H17 Cl N4 S |
| Smiles: | Cc1c(cccc1[Cl])N1C(c2ccc3c(c2)c(C)c(C)[nH]3)=NNC1=S |
| Stereo: | ACHIRAL |
| logP: | 5.4007 |
| logD: | 3.2153 |
| logSw: | -6.2336 |
| Hydrogen bond acceptors count: | 3 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 36.598 |
| InChI Key: | CCTKPFOMECCPNV-UHFFFAOYSA-N |