N-[(2H-1,3-benzodioxol-5-yl)methyl]-1-(3-oxo-3,4-dihydro-2H-1,4-benzothiazine-2-carbonyl)piperidine-4-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-4-carboxamide
N-[(2H-1,3-benzodioxol-5-yl)methyl]-1-(3-oxo-3,4-dihydro-2H-1,4-benzothiazine-2-carbonyl)piperidine-4-carboxamide
Compound characteristics
Compound ID: | L794-0075 |
Compound Name: | N-[(2H-1,3-benzodioxol-5-yl)methyl]-1-(3-oxo-3,4-dihydro-2H-1,4-benzothiazine-2-carbonyl)piperidine-4-carboxamide |
Molecular Weight: | 453.52 |
Molecular Formula: | C23 H23 N3 O5 S |
Smiles: | C1CN(CCC1C(NCc1ccc2c(c1)OCO2)=O)C(C1C(Nc2ccccc2S1)=O)=O |
Stereo: | RACEMIC MIXTURE |
logP: | 1.7582 |
logD: | 1.7582 |
logSw: | -2.5643 |
Hydrogen bond acceptors count: | 9 |
Hydrogen bond donors count: | 2 |
Polar surface area: | 83.293 |
InChI Key: | RKNCVXLISCRKKK-HXUWFJFHSA-N |