ethyl 5-{3-[(2,1,3-benzoxadiazole-5-carbonyl)amino]phenyl}-1-(2-fluorophenyl)-1H-pyrazole-3-carboxylate
Chemical Structure Depiction of
ethyl 5-{3-[(2,1,3-benzoxadiazole-5-carbonyl)amino]phenyl}-1-(2-fluorophenyl)-1H-pyrazole-3-carboxylate
ethyl 5-{3-[(2,1,3-benzoxadiazole-5-carbonyl)amino]phenyl}-1-(2-fluorophenyl)-1H-pyrazole-3-carboxylate
Compound characteristics
| Compound ID: | V012-0427 |
| Compound Name: | ethyl 5-{3-[(2,1,3-benzoxadiazole-5-carbonyl)amino]phenyl}-1-(2-fluorophenyl)-1H-pyrazole-3-carboxylate |
| Molecular Weight: | 471.45 |
| Molecular Formula: | C25 H18 F N5 O4 |
| Smiles: | CCOC(c1cc(c2cccc(c2)NC(c2ccc3c(c2)non3)=O)n(c2ccccc2F)n1)=O |
| Stereo: | ACHIRAL |
| logP: | 5.366 |
| logD: | 5.366 |
| logSw: | -5.4296 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 91.925 |
| InChI Key: | JJCRMHKWOXWWSJ-UHFFFAOYSA-N |