N-(2H-1,3-benzodioxol-5-yl)-N~2~-(4-ethoxyphenyl)-N~2~-(methanesulfonyl)alaninamide
Chemical Structure Depiction of
N-(2H-1,3-benzodioxol-5-yl)-N~2~-(4-ethoxyphenyl)-N~2~-(methanesulfonyl)alaninamide
N-(2H-1,3-benzodioxol-5-yl)-N~2~-(4-ethoxyphenyl)-N~2~-(methanesulfonyl)alaninamide
Compound characteristics
Compound ID: | 4567-2114 |
Compound Name: | N-(2H-1,3-benzodioxol-5-yl)-N~2~-(4-ethoxyphenyl)-N~2~-(methanesulfonyl)alaninamide |
Molecular Weight: | 406.46 |
Molecular Formula: | C19 H22 N2 O6 S |
Smiles: | CCOc1ccc(cc1)N(C(C)C(Nc1ccc2c(c1)OCO2)=O)S(C)(=O)=O |
Stereo: | RACEMIC MIXTURE |
logP: | 2.8445 |
logD: | 2.8444 |
logSw: | -3.5218 |
Hydrogen bond acceptors count: | 9 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 79.669 |
InChI Key: | SNTUIMQFLMFKJO-ZDUSSCGKSA-N |