N-(2H-1,3-benzodioxol-5-yl)-N-{1-[(4-hydroxy-3-methoxyphenyl)methyl]piperidin-4-yl}-4-methylbenzene-1-sulfonamide
Chemical Structure Depiction of
N-(2H-1,3-benzodioxol-5-yl)-N-{1-[(4-hydroxy-3-methoxyphenyl)methyl]piperidin-4-yl}-4-methylbenzene-1-sulfonamide
N-(2H-1,3-benzodioxol-5-yl)-N-{1-[(4-hydroxy-3-methoxyphenyl)methyl]piperidin-4-yl}-4-methylbenzene-1-sulfonamide
Compound characteristics
| Compound ID: | V021-4697 |
| Compound Name: | N-(2H-1,3-benzodioxol-5-yl)-N-{1-[(4-hydroxy-3-methoxyphenyl)methyl]piperidin-4-yl}-4-methylbenzene-1-sulfonamide |
| Molecular Weight: | 510.61 |
| Molecular Formula: | C27 H30 N2 O6 S |
| Smiles: | Cc1ccc(cc1)S(N(C1CCN(CC1)Cc1ccc(c(c1)OC)O)c1ccc2c(c1)OCO2)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.6596 |
| logD: | 3.2734 |
| logSw: | -4.1295 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 77.018 |
| InChI Key: | HOCKFIQYJPMLDZ-UHFFFAOYSA-N |