2-{4-[5-(4-methylphenyl)-1H-1,2,3-triazol-1-yl]phenyl}-2-oxoethyl 2-fluorobenzoate
Chemical Structure Depiction of
2-{4-[5-(4-methylphenyl)-1H-1,2,3-triazol-1-yl]phenyl}-2-oxoethyl 2-fluorobenzoate
2-{4-[5-(4-methylphenyl)-1H-1,2,3-triazol-1-yl]phenyl}-2-oxoethyl 2-fluorobenzoate
Compound characteristics
| Compound ID: | K415-0393 |
| Compound Name: | 2-{4-[5-(4-methylphenyl)-1H-1,2,3-triazol-1-yl]phenyl}-2-oxoethyl 2-fluorobenzoate |
| Molecular Weight: | 415.42 |
| Molecular Formula: | C24 H18 F N3 O3 |
| Smiles: | Cc1ccc(cc1)c1cnnn1c1ccc(cc1)C(COC(c1ccccc1F)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.8194 |
| logD: | 4.8194 |
| logSw: | -4.6117 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 60.327 |
| InChI Key: | FJWZASGKSDQTEN-UHFFFAOYSA-N |