(2-chlorophenyl)methyl 1-(4-bromophenyl)-5-methyl-1H-1,2,3-triazole-4-carboxylate
Chemical Structure Depiction of
(2-chlorophenyl)methyl 1-(4-bromophenyl)-5-methyl-1H-1,2,3-triazole-4-carboxylate
(2-chlorophenyl)methyl 1-(4-bromophenyl)-5-methyl-1H-1,2,3-triazole-4-carboxylate
Compound characteristics
Compound ID: | F152-0083 |
Compound Name: | (2-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)OCc2ccccc2[Cl])nnn1c1ccc(cc1)[Br] |
Stereo: | ACHIRAL |
logP: | 4.3049 |
logD: | 4.3049 |
logSw: | -4.3301 |
Hydrogen bond acceptors count: | 5 |
Polar surface area: | 47.939 |
InChI Key: | VCCZOAFUHAMTBK-UHFFFAOYSA-N |