(2-methylphenyl)methyl 5-methyl-1-[3-(methylsulfanyl)phenyl]-1H-1,2,3-triazole-4-carboxylate
Chemical Structure Depiction of
(2-methylphenyl)methyl 5-methyl-1-[3-(methylsulfanyl)phenyl]-1H-1,2,3-triazole-4-carboxylate
(2-methylphenyl)methyl 5-methyl-1-[3-(methylsulfanyl)phenyl]-1H-1,2,3-triazole-4-carboxylate
Compound characteristics
| Compound ID: | F152-0324 |
| Compound Name: | (2-methylphenyl)methyl 5-methyl-1-[3-(methylsulfanyl)phenyl]-1H-1,2,3-triazole-4-carboxylate |
| Molecular Weight: | 353.44 |
| Molecular Formula: | C19 H19 N3 O2 S |
| Smiles: | Cc1ccccc1COC(c1c(C)n(c2cccc(c2)SC)nn1)=O |
| Stereo: | ACHIRAL |
| logP: | 3.9998 |
| logD: | 3.9998 |
| logSw: | -4.1442 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 47.939 |
| InChI Key: | CYKNVRFXAUKYNI-UHFFFAOYSA-N |