1-(2,1,3-benzoxadiazole-4-sulfonyl)-N-[(3,4-dimethoxyphenyl)methyl]piperidine-4-carboxamide
Chemical Structure Depiction of
1-(2,1,3-benzoxadiazole-4-sulfonyl)-N-[(3,4-dimethoxyphenyl)methyl]piperidine-4-carboxamide
1-(2,1,3-benzoxadiazole-4-sulfonyl)-N-[(3,4-dimethoxyphenyl)methyl]piperidine-4-carboxamide
Compound characteristics
Compound ID: | G940-0236 |
Compound Name: | 1-(2,1,3-benzoxadiazole-4-sulfonyl)-N-[(3,4-dimethoxyphenyl)methyl]piperidine-4-carboxamide |
Molecular Weight: | 460.51 |
Molecular Formula: | C21 H24 N4 O6 S |
Smiles: | COc1ccc(CNC(C2CCN(CC2)S(c2cccc3c2non3)(=O)=O)=O)cc1OC |
Stereo: | ACHIRAL |
logP: | 1.9932 |
logD: | 1.9932 |
logSw: | -2.7115 |
Hydrogen bond acceptors count: | 12 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 107.713 |
InChI Key: | KZVWSWQIZCWVBA-UHFFFAOYSA-N |