N-[2-(4-phenylpiperazine-1-carbonyl)phenyl]-2H-1,3-benzodioxole-5-carboxamide
Chemical Structure Depiction of
N-[2-(4-phenylpiperazine-1-carbonyl)phenyl]-2H-1,3-benzodioxole-5-carboxamide
N-[2-(4-phenylpiperazine-1-carbonyl)phenyl]-2H-1,3-benzodioxole-5-carboxamide
Compound characteristics
| Compound ID: | Y031-1465 |
| Compound Name: | N-[2-(4-phenylpiperazine-1-carbonyl)phenyl]-2H-1,3-benzodioxole-5-carboxamide |
| Molecular Weight: | 429.47 |
| Molecular Formula: | C25 H23 N3 O4 |
| Smiles: | C1CN(CCN1C(c1ccccc1NC(c1ccc2c(c1)OCO2)=O)=O)c1ccccc1 |
| Stereo: | ACHIRAL |
| logP: | 3.773 |
| logD: | 3.7663 |
| logSw: | -4.0669 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 59.656 |
| InChI Key: | KKKVTLKSGWLFCA-UHFFFAOYSA-N |