(3-methylphenyl)methyl 1-(3-fluorophenyl)-5-methyl-1H-1,2,3-triazole-4-carboxylate
Chemical Structure Depiction of
(3-methylphenyl)methyl 1-(3-fluorophenyl)-5-methyl-1H-1,2,3-triazole-4-carboxylate
(3-methylphenyl)methyl 1-(3-fluorophenyl)-5-methyl-1H-1,2,3-triazole-4-carboxylate
Compound characteristics
| Compound ID: | F152-0638 |
| Compound Name: | (3-methylphenyl)methyl 1-(3-fluorophenyl)-5-methyl-1H-1,2,3-triazole-4-carboxylate |
| Molecular Weight: | 325.34 |
| Molecular Formula: | C18 H16 F N3 O2 |
| Smiles: | Cc1cccc(COC(c2c(C)n(c3cccc(c3)F)nn2)=O)c1 |
| Stereo: | ACHIRAL |
| logP: | 3.7631 |
| logD: | 3.7631 |
| logSw: | -4.0359 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 47.939 |
| InChI Key: | KIYWQTXRPFRXMS-UHFFFAOYSA-N |