ethyl 2-({[5-(4-fluorophenyl)-4-(4-methylphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}methyl)-1,3-thiazole-4-carboxylate
Chemical Structure Depiction of
ethyl 2-({[5-(4-fluorophenyl)-4-(4-methylphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}methyl)-1,3-thiazole-4-carboxylate
ethyl 2-({[5-(4-fluorophenyl)-4-(4-methylphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}methyl)-1,3-thiazole-4-carboxylate
Compound characteristics
| Compound ID: | V010-1949 |
| Compound Name: | ethyl 2-({[5-(4-fluorophenyl)-4-(4-methylphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}methyl)-1,3-thiazole-4-carboxylate |
| Molecular Weight: | 454.54 |
| Molecular Formula: | C22 H19 F N4 O2 S2 |
| Salt: | not_available |
| Smiles: | CCOC(c1csc(CSc2nnc(c3ccc(cc3)F)n2c2ccc(C)cc2)n1)=O |
| Stereo: | ACHIRAL |
| logP: | 5.4726 |
| logD: | 5.4726 |
| logSw: | -5.3627 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 55.967 |
| InChI Key: | AHWSJDVFSPKKDS-UHFFFAOYSA-N |