2-({[5-(2-chlorophenyl)-4-(3-chlorophenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}methyl)-1,3-thiazole-4-carboxylic acid
Chemical Structure Depiction of
2-({[5-(2-chlorophenyl)-4-(3-chlorophenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}methyl)-1,3-thiazole-4-carboxylic acid
2-({[5-(2-chlorophenyl)-4-(3-chlorophenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}methyl)-1,3-thiazole-4-carboxylic acid
Compound characteristics
| Compound ID: | V026-7049 |
| Compound Name: | 2-({[5-(2-chlorophenyl)-4-(3-chlorophenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}methyl)-1,3-thiazole-4-carboxylic acid |
| Molecular Weight: | 463.36 |
| Molecular Formula: | C19 H12 Cl2 N4 O2 S2 |
| Salt: | not_available |
| Smiles: | C(c1nc(cs1)C(O)=O)Sc1nnc(c2ccccc2[Cl])n1c1cccc(c1)[Cl] |
| Stereo: | ACHIRAL |
| logP: | 4.9715 |
| logD: | 1.5455 |
| logSw: | -4.5193 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 63.621 |
| InChI Key: | ZEZWMAUVGSXIIS-UHFFFAOYSA-N |