2-{4-[5-(4-bromophenyl)-1H-1,2,3-triazol-1-yl]phenyl}-2-oxoethyl 2-fluorobenzoate
Chemical Structure Depiction of
2-{4-[5-(4-bromophenyl)-1H-1,2,3-triazol-1-yl]phenyl}-2-oxoethyl 2-fluorobenzoate
2-{4-[5-(4-bromophenyl)-1H-1,2,3-triazol-1-yl]phenyl}-2-oxoethyl 2-fluorobenzoate
Compound characteristics
| Compound ID: | K415-0384 |
| Compound Name: | 2-{4-[5-(4-bromophenyl)-1H-1,2,3-triazol-1-yl]phenyl}-2-oxoethyl 2-fluorobenzoate |
| Molecular Weight: | 480.29 |
| Molecular Formula: | C23 H15 Br F N3 O3 |
| Smiles: | C(C(c1ccc(cc1)n1c(cnn1)c1ccc(cc1)[Br])=O)OC(c1ccccc1F)=O |
| Stereo: | ACHIRAL |
| logP: | 5.2299 |
| logD: | 5.2299 |
| logSw: | -5.2807 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 60.327 |
| InChI Key: | ZEVPSMSAGFZIKE-UHFFFAOYSA-N |