N-(2H-1,3-benzodioxol-5-yl)-2-[3-(4-methylbenzene-1-sulfonyl)-4-oxoquinolin-1(4H)-yl]acetamide
Chemical Structure Depiction of
N-(2H-1,3-benzodioxol-5-yl)-2-[3-(4-methylbenzene-1-sulfonyl)-4-oxoquinolin-1(4H)-yl]acetamide
N-(2H-1,3-benzodioxol-5-yl)-2-[3-(4-methylbenzene-1-sulfonyl)-4-oxoquinolin-1(4H)-yl]acetamide
Compound characteristics
| Compound ID: | C655-0239 |
| Compound Name: | N-(2H-1,3-benzodioxol-5-yl)-2-[3-(4-methylbenzene-1-sulfonyl)-4-oxoquinolin-1(4H)-yl]acetamide |
| Molecular Weight: | 476.51 |
| Molecular Formula: | C25 H20 N2 O6 S |
| Smiles: | Cc1ccc(cc1)S(C1=CN(CC(Nc2ccc3c(c2)OCO3)=O)c2ccccc2C1=O)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.7803 |
| logD: | 3.7802 |
| logSw: | -4.0125 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 85.328 |
| InChI Key: | MGBRGBOMRYBOCD-UHFFFAOYSA-N |