(3-fluorophenyl)methyl 5-amino-2-phenyl-2H-1,2,3-triazole-4-carboxylate
Chemical Structure Depiction of
(3-fluorophenyl)methyl 5-amino-2-phenyl-2H-1,2,3-triazole-4-carboxylate
(3-fluorophenyl)methyl 5-amino-2-phenyl-2H-1,2,3-triazole-4-carboxylate
Compound characteristics
| Compound ID: | 8016-0098 |
| Compound Name: | (3-fluorophenyl)methyl 5-amino-2-phenyl-2H-1,2,3-triazole-4-carboxylate |
| Molecular Weight: | 312.3 |
| Molecular Formula: | C16 H13 F N4 O2 |
| Smiles: | C(c1cccc(c1)F)OC(c1c(N)nn(c2ccccc2)n1)=O |
| Stereo: | ACHIRAL |
| logP: | 2.3252 |
| logD: | 2.3252 |
| logSw: | -2.7002 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 66.896 |
| InChI Key: | SSXZPNGBXXEABB-UHFFFAOYSA-N |