4-[4-(2H-1,3-benzodioxol-5-yl)-1,3-thiazol-2-yl]-1-(3-chloro-4-methylphenyl)-1H-1,2,3-triazol-5-amine
Chemical Structure Depiction of
4-[4-(2H-1,3-benzodioxol-5-yl)-1,3-thiazol-2-yl]-1-(3-chloro-4-methylphenyl)-1H-1,2,3-triazol-5-amine
4-[4-(2H-1,3-benzodioxol-5-yl)-1,3-thiazol-2-yl]-1-(3-chloro-4-methylphenyl)-1H-1,2,3-triazol-5-amine
Compound characteristics
| Compound ID: | F988-0728 |
| Compound Name: | 4-[4-(2H-1,3-benzodioxol-5-yl)-1,3-thiazol-2-yl]-1-(3-chloro-4-methylphenyl)-1H-1,2,3-triazol-5-amine |
| Molecular Weight: | 411.87 |
| Molecular Formula: | C19 H14 Cl N5 O2 S |
| Smiles: | Cc1ccc(cc1[Cl])n1c(c(c2nc(cs2)c2ccc3c(c2)OCO3)nn1)N |
| Stereo: | ACHIRAL |
| logP: | 5.0707 |
| logD: | 5.0707 |
| logSw: | -5.4345 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 72.91 |
| InChI Key: | MUPHHCJSEWUOSR-UHFFFAOYSA-N |