N-[(2H-1,3-benzodioxol-5-yl)methyl]-N~2~-methyl-N~2~-(2-oxo-1,2-dihydroquinoline-6-sulfonyl)glycinamide
Chemical Structure Depiction of
N-[(2H-1,3-benzodioxol-5-yl)methyl]-N~2~-methyl-N~2~-(2-oxo-1,2-dihydroquinoline-6-sulfonyl)glycinamide
N-[(2H-1,3-benzodioxol-5-yl)methyl]-N~2~-methyl-N~2~-(2-oxo-1,2-dihydroquinoline-6-sulfonyl)glycinamide
Compound characteristics
Compound ID: | E589-4573 |
Compound Name: | N-[(2H-1,3-benzodioxol-5-yl)methyl]-N~2~-methyl-N~2~-(2-oxo-1,2-dihydroquinoline-6-sulfonyl)glycinamide |
Molecular Weight: | 429.45 |
Molecular Formula: | C20 H19 N3 O6 S |
Smiles: | CN(CC(NCc1ccc2c(c1)OCO2)=O)S(c1ccc2c(C=CC(N2)=O)c1)(=O)=O |
Stereo: | ACHIRAL |
logP: | 1.8491 |
logD: | 1.8429 |
logSw: | -2.837 |
Hydrogen bond acceptors count: | 11 |
Hydrogen bond donors count: | 2 |
Polar surface area: | 99.21 |
InChI Key: | TZGVGOSQPFPEHV-UHFFFAOYSA-N |