methyl N-[1-(4-fluorophenyl)-5-phenyl-1H-1,2,4-triazole-3-carbonyl]glycinate
Chemical Structure Depiction of
methyl N-[1-(4-fluorophenyl)-5-phenyl-1H-1,2,4-triazole-3-carbonyl]glycinate
methyl N-[1-(4-fluorophenyl)-5-phenyl-1H-1,2,4-triazole-3-carbonyl]glycinate
Compound characteristics
| Compound ID: | D351-2587 |
| Compound Name: | methyl N-[1-(4-fluorophenyl)-5-phenyl-1H-1,2,4-triazole-3-carbonyl]glycinate |
| Molecular Weight: | 354.34 |
| Molecular Formula: | C18 H15 F N4 O3 |
| Smiles: | COC(CNC(c1nc(c2ccccc2)n(c2ccc(cc2)F)n1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.7372 |
| logD: | 2.7372 |
| logSw: | -3.1575 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 69.153 |
| InChI Key: | OBAJSWBFYFNDCU-UHFFFAOYSA-N |