ethyl 5-{3-[(2,1,3-benzoxadiazole-5-carbonyl)amino]phenyl}-1-(3-fluorophenyl)-1H-pyrazole-3-carboxylate
Chemical Structure Depiction of
ethyl 5-{3-[(2,1,3-benzoxadiazole-5-carbonyl)amino]phenyl}-1-(3-fluorophenyl)-1H-pyrazole-3-carboxylate
ethyl 5-{3-[(2,1,3-benzoxadiazole-5-carbonyl)amino]phenyl}-1-(3-fluorophenyl)-1H-pyrazole-3-carboxylate
Compound characteristics
| Compound ID: | V012-0225 |
| Compound Name: | ethyl 5-{3-[(2,1,3-benzoxadiazole-5-carbonyl)amino]phenyl}-1-(3-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(c2cccc(c2)F)n1)=O |
| Stereo: | ACHIRAL |
| logP: | 5.4572 |
| logD: | 5.4572 |
| logSw: | -5.4652 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 92.226 |
| InChI Key: | ZVSCUICCQKYMQA-UHFFFAOYSA-N |