(4-chlorophenyl)methyl 1-(4-bromophenyl)-5-methyl-1H-1,2,3-triazole-4-carboxylate
Chemical Structure Depiction of
(4-chlorophenyl)methyl 1-(4-bromophenyl)-5-methyl-1H-1,2,3-triazole-4-carboxylate
(4-chlorophenyl)methyl 1-(4-bromophenyl)-5-methyl-1H-1,2,3-triazole-4-carboxylate
Compound characteristics
| Compound ID: | F152-0093 |
| Compound Name: | (4-chlorophenyl)methyl 1-(4-bromophenyl)-5-methyl-1H-1,2,3-triazole-4-carboxylate |
| Molecular Weight: | 406.66 |
| Molecular Formula: | C17 H13 Br Cl N3 O2 |
| Smiles: | Cc1c(C(=O)OCc2ccc(cc2)[Cl])nnn1c1ccc(cc1)[Br] |
| Stereo: | ACHIRAL |
| logP: | 4.4248 |
| logD: | 4.4248 |
| logSw: | -4.5884 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 47.939 |
| InChI Key: | NDECVMIPDAYLET-UHFFFAOYSA-N |