(2-chlorophenyl)methyl 1-(4-bromo-3-methylphenyl)-5-methyl-1H-1,2,3-triazole-4-carboxylate
Chemical Structure Depiction of
(2-chlorophenyl)methyl 1-(4-bromo-3-methylphenyl)-5-methyl-1H-1,2,3-triazole-4-carboxylate
(2-chlorophenyl)methyl 1-(4-bromo-3-methylphenyl)-5-methyl-1H-1,2,3-triazole-4-carboxylate
Compound characteristics
| Compound ID: | F152-0369 |
| Compound Name: | (2-chlorophenyl)methyl 1-(4-bromo-3-methylphenyl)-5-methyl-1H-1,2,3-triazole-4-carboxylate |
| Molecular Weight: | 420.69 |
| Molecular Formula: | C18 H15 Br Cl N3 O2 |
| Smiles: | Cc1cc(ccc1[Br])n1c(C)c(C(=O)OCc2ccccc2[Cl])nn1 |
| Stereo: | ACHIRAL |
| logP: | 4.7856 |
| logD: | 4.7856 |
| logSw: | -4.7924 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 47.939 |
| InChI Key: | MHUKLPZNLAMSMQ-UHFFFAOYSA-N |