(2-fluorophenyl)methyl 1-(4-bromophenyl)-5-methyl-1H-1,2,3-triazole-4-carboxylate
Chemical Structure Depiction of
(2-fluorophenyl)methyl 1-(4-bromophenyl)-5-methyl-1H-1,2,3-triazole-4-carboxylate
(2-fluorophenyl)methyl 1-(4-bromophenyl)-5-methyl-1H-1,2,3-triazole-4-carboxylate
Compound characteristics
| Compound ID: | F152-0095 |
| Compound Name: | (2-fluorophenyl)methyl 1-(4-bromophenyl)-5-methyl-1H-1,2,3-triazole-4-carboxylate |
| Molecular Weight: | 390.21 |
| Molecular Formula: | C17 H13 Br F N3 O2 |
| Smiles: | Cc1c(C(=O)OCc2ccccc2F)nnn1c1ccc(cc1)[Br] |
| Stereo: | ACHIRAL |
| logP: | 3.9051 |
| logD: | 3.9051 |
| logSw: | -3.9675 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 47.939 |
| InChI Key: | FJNVLSGKMYNHHY-UHFFFAOYSA-N |