methyl 5-amino-1-(4-chloro-2-methylphenyl)-1H-1,2,3-triazole-4-carboxylate
Chemical Structure Depiction of
methyl 5-amino-1-(4-chloro-2-methylphenyl)-1H-1,2,3-triazole-4-carboxylate
methyl 5-amino-1-(4-chloro-2-methylphenyl)-1H-1,2,3-triazole-4-carboxylate
Compound characteristics
| Compound ID: | 8018-1323 |
| Compound Name: | methyl 5-amino-1-(4-chloro-2-methylphenyl)-1H-1,2,3-triazole-4-carboxylate |
| Molecular Weight: | 266.68 |
| Molecular Formula: | C11 H11 Cl N4 O2 |
| Smiles: | Cc1cc(ccc1n1c(c(C(=O)OC)nn1)N)[Cl] |
| Stereo: | ACHIRAL |
| logP: | 2.3542 |
| logD: | 2.3542 |
| logSw: | -2.9185 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 67.205 |
| InChI Key: | UXPBIYFIFFCJFP-UHFFFAOYSA-N |