N-[(2H-1,3-benzodioxol-5-yl)methyl]-2-oxo-6-(pyrrolidine-1-sulfonyl)-1,2-dihydroquinoline-4-carboxamide
Chemical Structure Depiction of
N-[(2H-1,3-benzodioxol-5-yl)methyl]-2-oxo-6-(pyrrolidine-1-sulfonyl)-1,2-dihydroquinoline-4-carboxamide
N-[(2H-1,3-benzodioxol-5-yl)methyl]-2-oxo-6-(pyrrolidine-1-sulfonyl)-1,2-dihydroquinoline-4-carboxamide
Compound characteristics
| Compound ID: | C208-0582 |
| Compound Name: | N-[(2H-1,3-benzodioxol-5-yl)methyl]-2-oxo-6-(pyrrolidine-1-sulfonyl)-1,2-dihydroquinoline-4-carboxamide |
| Molecular Weight: | 455.49 |
| Molecular Formula: | C22 H21 N3 O6 S |
| Smiles: | C1CCN(C1)S(c1ccc2c(c1)C(=CC(N2)=O)C(NCc1ccc2c(c1)OCO2)=O)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.091 |
| logD: | 2.0489 |
| logSw: | -3.1809 |
| Hydrogen bond acceptors count: | 11 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 98.665 |
| InChI Key: | SCWZVPCMRLFGRC-UHFFFAOYSA-N |