3-(2H-1,3-benzodioxol-5-yl)-4-{4-[(furan-2-carbonyl)amino]phenyl}-1-(4-methylphenyl)-1H-pyrazol-5-yl acetate
Chemical Structure Depiction of
3-(2H-1,3-benzodioxol-5-yl)-4-{4-[(furan-2-carbonyl)amino]phenyl}-1-(4-methylphenyl)-1H-pyrazol-5-yl acetate
3-(2H-1,3-benzodioxol-5-yl)-4-{4-[(furan-2-carbonyl)amino]phenyl}-1-(4-methylphenyl)-1H-pyrazol-5-yl acetate
Compound characteristics
| Compound ID: | V022-9483 |
| Compound Name: | 3-(2H-1,3-benzodioxol-5-yl)-4-{4-[(furan-2-carbonyl)amino]phenyl}-1-(4-methylphenyl)-1H-pyrazol-5-yl acetate |
| Molecular Weight: | 521.53 |
| Molecular Formula: | C30 H23 N3 O6 |
| Smiles: | CC(=O)Oc1c(c2ccc(cc2)NC(c2ccco2)=O)c(c2ccc3c(c2)OCO3)nn1c1ccc(C)cc1 |
| Stereo: | ACHIRAL |
| logP: | 5.7957 |
| logD: | 5.7956 |
| logSw: | -5.5264 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 83.359 |
| InChI Key: | JMRQYPBMJDXXGO-UHFFFAOYSA-N |