N-[(2H-1,3-benzodioxol-5-yl)methyl]-1-(2-oxo-1,2-dihydroquinoline-6-sulfonyl)piperidine-4-carboxamide
Chemical Structure Depiction of
N-[(2H-1,3-benzodioxol-5-yl)methyl]-1-(2-oxo-1,2-dihydroquinoline-6-sulfonyl)piperidine-4-carboxamide
N-[(2H-1,3-benzodioxol-5-yl)methyl]-1-(2-oxo-1,2-dihydroquinoline-6-sulfonyl)piperidine-4-carboxamide
Compound characteristics
| Compound ID: | E459-0060 |
| Compound Name: | N-[(2H-1,3-benzodioxol-5-yl)methyl]-1-(2-oxo-1,2-dihydroquinoline-6-sulfonyl)piperidine-4-carboxamide |
| Molecular Weight: | 469.52 |
| Molecular Formula: | C23 H23 N3 O6 S |
| Smiles: | C1CN(CCC1C(NCc1ccc2c(c1)OCO2)=O)S(c1ccc2c(C=CC(N2)=O)c1)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.0724 |
| logD: | 2.0662 |
| logSw: | -2.9825 |
| Hydrogen bond acceptors count: | 11 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 98.299 |
| InChI Key: | ZQARWLSZQRVLAS-UHFFFAOYSA-N |