4-{4-[(2H-1,3-benzodioxole-5-carbonyl)amino]phenyl}-3-cyclopropyl-1-phenyl-1H-pyrazol-5-yl acetate
Chemical Structure Depiction of
4-{4-[(2H-1,3-benzodioxole-5-carbonyl)amino]phenyl}-3-cyclopropyl-1-phenyl-1H-pyrazol-5-yl acetate
4-{4-[(2H-1,3-benzodioxole-5-carbonyl)amino]phenyl}-3-cyclopropyl-1-phenyl-1H-pyrazol-5-yl acetate
Compound characteristics
| Compound ID: | V030-3149 |
| Compound Name: | 4-{4-[(2H-1,3-benzodioxole-5-carbonyl)amino]phenyl}-3-cyclopropyl-1-phenyl-1H-pyrazol-5-yl acetate |
| Molecular Weight: | 481.51 |
| Molecular Formula: | C28 H23 N3 O5 |
| Salt: | not_available |
| Smiles: | CC(=O)Oc1c(c2ccc(cc2)NC(c2ccc3c(c2)OCO3)=O)c(C2CC2)nn1c1ccccc1 |
| Stereo: | ACHIRAL |
| logP: | 5.5795 |
| logD: | 5.5795 |
| logSw: | -5.5352 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 75.304 |
| InChI Key: | DCLDSDMKCTZSFD-UHFFFAOYSA-N |