4-{4-[(2H-1,3-benzodioxole-5-carbonyl)amino]phenyl}-1-(3-fluorophenyl)-3-(3-methylphenyl)-1H-pyrazol-5-yl acetate
Chemical Structure Depiction of
4-{4-[(2H-1,3-benzodioxole-5-carbonyl)amino]phenyl}-1-(3-fluorophenyl)-3-(3-methylphenyl)-1H-pyrazol-5-yl acetate
4-{4-[(2H-1,3-benzodioxole-5-carbonyl)amino]phenyl}-1-(3-fluorophenyl)-3-(3-methylphenyl)-1H-pyrazol-5-yl acetate
Compound characteristics
| Compound ID: | V020-9894 |
| Compound Name: | 4-{4-[(2H-1,3-benzodioxole-5-carbonyl)amino]phenyl}-1-(3-fluorophenyl)-3-(3-methylphenyl)-1H-pyrazol-5-yl acetate |
| Molecular Weight: | 549.56 |
| Molecular Formula: | C32 H24 F N3 O5 |
| Smiles: | CC(=O)Oc1c(c2ccc(cc2)NC(c2ccc3c(c2)OCO3)=O)c(c2cccc(C)c2)nn1c1cccc(c1)F |
| Stereo: | ACHIRAL |
| logP: | 6.5412 |
| logD: | 6.5412 |
| logSw: | -5.7413 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 74.781 |
| InChI Key: | ZRFDPWQBZBKRRR-UHFFFAOYSA-N |