N-(2H-1,3-benzodioxol-5-yl)-1-(4-methylbenzene-1-sulfonyl)piperidine-4-carboxamide
Chemical Structure Depiction of
N-(2H-1,3-benzodioxol-5-yl)-1-(4-methylbenzene-1-sulfonyl)piperidine-4-carboxamide
N-(2H-1,3-benzodioxol-5-yl)-1-(4-methylbenzene-1-sulfonyl)piperidine-4-carboxamide
Compound characteristics
| Compound ID: | 5641-1631 |
| Compound Name: | N-(2H-1,3-benzodioxol-5-yl)-1-(4-methylbenzene-1-sulfonyl)piperidine-4-carboxamide |
| Molecular Weight: | 402.47 |
| Molecular Formula: | C20 H22 N2 O5 S |
| Smiles: | Cc1ccc(cc1)S(N1CCC(CC1)C(Nc1ccc2c(c1)OCO2)=O)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.0028 |
| logD: | 3.0026 |
| logSw: | -3.3784 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 72.156 |
| InChI Key: | BNTMVYHIVDPQDB-UHFFFAOYSA-N |