N-[(2H-1,3-benzodioxol-5-yl)methyl]-1-(4-methoxy-3-methylbenzene-1-sulfonyl)piperidine-3-carboxamide
Chemical Structure Depiction of
N-[(2H-1,3-benzodioxol-5-yl)methyl]-1-(4-methoxy-3-methylbenzene-1-sulfonyl)piperidine-3-carboxamide
N-[(2H-1,3-benzodioxol-5-yl)methyl]-1-(4-methoxy-3-methylbenzene-1-sulfonyl)piperidine-3-carboxamide
Compound characteristics
| Compound ID: | Y050-0476 |
| Compound Name: | N-[(2H-1,3-benzodioxol-5-yl)methyl]-1-(4-methoxy-3-methylbenzene-1-sulfonyl)piperidine-3-carboxamide |
| Molecular Weight: | 446.52 |
| Molecular Formula: | C22 H26 N2 O6 S |
| Smiles: | Cc1cc(ccc1OC)S(N1CCCC(C1)C(NCc1ccc2c(c1)OCO2)=O)(=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.7179 |
| logD: | 2.7179 |
| logSw: | -3.3118 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 81.042 |
| InChI Key: | PUIBARDCCSLSKF-KRWDZBQOSA-N |