1-(2H-1,3-benzodioxol-5-yl)-N-(1,3-benzothiazol-2-yl)-6-oxo-2-(3,4,5-trimethoxyphenyl)piperidine-3-carboxamide
Chemical Structure Depiction of
1-(2H-1,3-benzodioxol-5-yl)-N-(1,3-benzothiazol-2-yl)-6-oxo-2-(3,4,5-trimethoxyphenyl)piperidine-3-carboxamide
1-(2H-1,3-benzodioxol-5-yl)-N-(1,3-benzothiazol-2-yl)-6-oxo-2-(3,4,5-trimethoxyphenyl)piperidine-3-carboxamide
Compound characteristics
| Compound ID: | C115-0694 |
| Compound Name: | 1-(2H-1,3-benzodioxol-5-yl)-N-(1,3-benzothiazol-2-yl)-6-oxo-2-(3,4,5-trimethoxyphenyl)piperidine-3-carboxamide |
| Molecular Weight: | 561.61 |
| Molecular Formula: | C29 H27 N3 O7 S |
| Smiles: | COc1cc(cc(c1OC)OC)C1C(CCC(N1c1ccc2c(c1)OCO2)=O)C(Nc1nc2ccccc2s1)=O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 4.8598 |
| logD: | 4.8561 |
| logSw: | -4.7425 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 88.535 |
| InChI Key: | HIJVAURZIBOXHH-UHFFFAOYSA-N |