methyl 5-amino-1-(3-methylphenyl)-1H-1,2,3-triazole-4-carboxylate
Chemical Structure Depiction of
methyl 5-amino-1-(3-methylphenyl)-1H-1,2,3-triazole-4-carboxylate
methyl 5-amino-1-(3-methylphenyl)-1H-1,2,3-triazole-4-carboxylate
Compound characteristics
| Compound ID: | 8017-8044 |
| Compound Name: | methyl 5-amino-1-(3-methylphenyl)-1H-1,2,3-triazole-4-carboxylate |
| Molecular Weight: | 232.24 |
| Molecular Formula: | C11 H12 N4 O2 |
| Smiles: | Cc1cccc(c1)n1c(c(C(=O)OC)nn1)N |
| Stereo: | ACHIRAL |
| logP: | 1.3695 |
| logD: | 1.3695 |
| logSw: | -1.8179 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 67.506 |
| InChI Key: | YFGOMJVOGHNAAY-UHFFFAOYSA-N |