ethyl 2-({[5-(3-methoxyphenyl)-4-phenyl-4H-1,2,4-triazol-3-yl]sulfanyl}methyl)-1,3-thiazole-4-carboxylate
Chemical Structure Depiction of
ethyl 2-({[5-(3-methoxyphenyl)-4-phenyl-4H-1,2,4-triazol-3-yl]sulfanyl}methyl)-1,3-thiazole-4-carboxylate
ethyl 2-({[5-(3-methoxyphenyl)-4-phenyl-4H-1,2,4-triazol-3-yl]sulfanyl}methyl)-1,3-thiazole-4-carboxylate
Compound characteristics
| Compound ID: | V026-3614 |
| Compound Name: | ethyl 2-({[5-(3-methoxyphenyl)-4-phenyl-4H-1,2,4-triazol-3-yl]sulfanyl}methyl)-1,3-thiazole-4-carboxylate |
| Molecular Weight: | 452.55 |
| Molecular Formula: | C22 H20 N4 O3 S2 |
| Salt: | not_available |
| Smiles: | CCOC(c1csc(CSc2nnc(c3cccc(c3)OC)n2c2ccccc2)n1)=O |
| Stereo: | ACHIRAL |
| logP: | 4.959 |
| logD: | 4.959 |
| logSw: | -4.6837 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 63.511 |
| InChI Key: | MIPQMMNVTXQVJJ-UHFFFAOYSA-N |