(2,5-dimethylphenyl)methyl 1-(3,4-dimethylphenyl)-5-methyl-1H-1,2,3-triazole-4-carboxylate
Chemical Structure Depiction of
(2,5-dimethylphenyl)methyl 1-(3,4-dimethylphenyl)-5-methyl-1H-1,2,3-triazole-4-carboxylate
(2,5-dimethylphenyl)methyl 1-(3,4-dimethylphenyl)-5-methyl-1H-1,2,3-triazole-4-carboxylate
Compound characteristics
| Compound ID: | F152-0120 |
| Compound Name: | (2,5-dimethylphenyl)methyl 1-(3,4-dimethylphenyl)-5-methyl-1H-1,2,3-triazole-4-carboxylate |
| Molecular Weight: | 349.43 |
| Molecular Formula: | C21 H23 N3 O2 |
| Smiles: | Cc1ccc(C)c(COC(c2c(C)n(c3ccc(C)c(C)c3)nn2)=O)c1 |
| Stereo: | ACHIRAL |
| logP: | 5.1397 |
| logD: | 5.1397 |
| logSw: | -4.9933 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 47.939 |
| InChI Key: | HKFYBHWTNYQUMM-UHFFFAOYSA-N |