2-{4-[5-(4-fluorophenyl)-1H-1,2,3-triazol-1-yl]phenyl}-2-oxoethyl 3-phenylprop-2-enoate
Chemical Structure Depiction of
2-{4-[5-(4-fluorophenyl)-1H-1,2,3-triazol-1-yl]phenyl}-2-oxoethyl 3-phenylprop-2-enoate
2-{4-[5-(4-fluorophenyl)-1H-1,2,3-triazol-1-yl]phenyl}-2-oxoethyl 3-phenylprop-2-enoate
Compound characteristics
| Compound ID: | K415-0385 |
| Compound Name: | 2-{4-[5-(4-fluorophenyl)-1H-1,2,3-triazol-1-yl]phenyl}-2-oxoethyl 3-phenylprop-2-enoate |
| Molecular Weight: | 427.43 |
| Molecular Formula: | C25 H18 F N3 O3 |
| Smiles: | C(C(c1ccc(cc1)n1c(cnn1)c1ccc(cc1)F)=O)OC(/C=C/c1ccccc1)=O |
| Stereo: | ACHIRAL |
| logP: | 5.1282 |
| logD: | 5.1282 |
| logSw: | -5.2825 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 59.732 |
| InChI Key: | CECFPBUFPUEXJR-UHFFFAOYSA-N |