3-(2H-1,3-benzodioxol-5-yl)-N-[2-(4-phenylpiperazine-1-carbonyl)phenyl]prop-2-enamide
Chemical Structure Depiction of
3-(2H-1,3-benzodioxol-5-yl)-N-[2-(4-phenylpiperazine-1-carbonyl)phenyl]prop-2-enamide
3-(2H-1,3-benzodioxol-5-yl)-N-[2-(4-phenylpiperazine-1-carbonyl)phenyl]prop-2-enamide
Compound characteristics
| Compound ID: | Y032-3900 |
| Compound Name: | 3-(2H-1,3-benzodioxol-5-yl)-N-[2-(4-phenylpiperazine-1-carbonyl)phenyl]prop-2-enamide |
| Molecular Weight: | 455.51 |
| Molecular Formula: | C27 H25 N3 O4 |
| Smiles: | C1CN(CCN1C(c1ccccc1NC(/C=C/c1ccc2c(c1)OCO2)=O)=O)c1ccccc1 |
| Stereo: | ACHIRAL |
| logP: | 4.6323 |
| logD: | 4.6304 |
| logSw: | -4.5745 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 59.443 |
| InChI Key: | ABZQNYQJQHVBPL-UHFFFAOYSA-N |