[2-(4-chlorophenyl)-5-methyl-1,3-oxazol-4-yl]methyl 5-methyl-1-[3-(methylsulfanyl)phenyl]-1H-1,2,3-triazole-4-carboxylate
Chemical Structure Depiction of
[2-(4-chlorophenyl)-5-methyl-1,3-oxazol-4-yl]methyl 5-methyl-1-[3-(methylsulfanyl)phenyl]-1H-1,2,3-triazole-4-carboxylate
[2-(4-chlorophenyl)-5-methyl-1,3-oxazol-4-yl]methyl 5-methyl-1-[3-(methylsulfanyl)phenyl]-1H-1,2,3-triazole-4-carboxylate
Compound characteristics
Compound ID: | F152-0301 |
Compound Name: | [2-(4-chlorophenyl)-5-methyl-1,3-oxazol-4-yl]methyl 5-methyl-1-[3-(methylsulfanyl)phenyl]-1H-1,2,3-triazole-4-carboxylate |
Molecular Weight: | 454.93 |
Molecular Formula: | C22 H19 Cl N4 O3 S |
Smiles: | Cc1c(C(=O)OCc2c(C)oc(c3ccc(cc3)[Cl])n2)nnn1c1cccc(c1)SC |
Stereo: | ACHIRAL |
logP: | 4.5029 |
logD: | 4.5029 |
logSw: | -4.7474 |
Hydrogen bond acceptors count: | 8 |
Polar surface area: | 66.061 |
InChI Key: | CGPBJOZMGOBSRE-UHFFFAOYSA-N |