N-[(2H-1,3-benzodioxol-5-yl)methyl]-N~2~-(4-methoxy-3-methylbenzene-1-sulfonyl)alaninamide
Chemical Structure Depiction of
N-[(2H-1,3-benzodioxol-5-yl)methyl]-N~2~-(4-methoxy-3-methylbenzene-1-sulfonyl)alaninamide
N-[(2H-1,3-benzodioxol-5-yl)methyl]-N~2~-(4-methoxy-3-methylbenzene-1-sulfonyl)alaninamide
Compound characteristics
| Compound ID: | Y050-1222 |
| Compound Name: | N-[(2H-1,3-benzodioxol-5-yl)methyl]-N~2~-(4-methoxy-3-methylbenzene-1-sulfonyl)alaninamide |
| Molecular Weight: | 406.46 |
| Molecular Formula: | C19 H22 N2 O6 S |
| Smiles: | CC(C(NCc1ccc2c(c1)OCO2)=O)NS(c1ccc(c(C)c1)OC)(=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.3322 |
| logD: | 2.332 |
| logSw: | -2.7939 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 90.804 |
| InChI Key: | VRPFBERXWSWILB-ZDUSSCGKSA-N |