N-[(2H-1,3-benzodioxol-5-yl)methyl]-1-(3-oxo-3,4-dihydro-2H-1,4-benzothiazine-2-carbonyl)piperidine-3-carboxamide
Chemical Structure Depiction of
N-[(2H-1,3-benzodioxol-5-yl)methyl]-1-(3-oxo-3,4-dihydro-2H-1,4-benzothiazine-2-carbonyl)piperidine-3-carboxamide
N-[(2H-1,3-benzodioxol-5-yl)methyl]-1-(3-oxo-3,4-dihydro-2H-1,4-benzothiazine-2-carbonyl)piperidine-3-carboxamide
Compound characteristics
| Compound ID: | L795-0075 |
| Compound Name: | N-[(2H-1,3-benzodioxol-5-yl)methyl]-1-(3-oxo-3,4-dihydro-2H-1,4-benzothiazine-2-carbonyl)piperidine-3-carboxamide |
| Molecular Weight: | 453.52 |
| Molecular Formula: | C23 H23 N3 O5 S |
| Smiles: | C1CC(CN(C1)C(C1C(Nc2ccccc2S1)=O)=O)C(NCc1ccc2c(c1)OCO2)=O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 1.8288 |
| logD: | 1.8288 |
| logSw: | -2.5084 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 83.227 |
| InChI Key: | DZMMNOHTAXVOTN-UHFFFAOYSA-N |