ethyl 4-[2-({[5-(2-chlorophenyl)-4-(3-chlorophenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}methyl)-1,3-thiazole-4-carbonyl]piperazine-1-carboxylate
Chemical Structure Depiction of
ethyl 4-[2-({[5-(2-chlorophenyl)-4-(3-chlorophenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}methyl)-1,3-thiazole-4-carbonyl]piperazine-1-carboxylate
ethyl 4-[2-({[5-(2-chlorophenyl)-4-(3-chlorophenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}methyl)-1,3-thiazole-4-carbonyl]piperazine-1-carboxylate
Compound characteristics
| Compound ID: | V021-1740 |
| Compound Name: | ethyl 4-[2-({[5-(2-chlorophenyl)-4-(3-chlorophenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}methyl)-1,3-thiazole-4-carbonyl]piperazine-1-carboxylate |
| Molecular Weight: | 603.55 |
| Molecular Formula: | C26 H24 Cl2 N6 O3 S2 |
| Salt: | not_available |
| Smiles: | CCOC(N1CCN(CC1)C(c1csc(CSc2nnc(c3ccccc3[Cl])n2c2cccc(c2)[Cl])n1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 5.5789 |
| logD: | 5.5789 |
| logSw: | -5.7897 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 74.642 |
| InChI Key: | JPQFZUSUHKNYJF-UHFFFAOYSA-N |