N-[2-(3,4-dimethoxyphenyl)ethyl]-1-(3-oxo-3,4-dihydro-2H-1,4-benzothiazine-2-carbonyl)piperidine-4-carboxamide
Chemical Structure Depiction of
N-[2-(3,4-dimethoxyphenyl)ethyl]-1-(3-oxo-3,4-dihydro-2H-1,4-benzothiazine-2-carbonyl)piperidine-4-carboxamide
N-[2-(3,4-dimethoxyphenyl)ethyl]-1-(3-oxo-3,4-dihydro-2H-1,4-benzothiazine-2-carbonyl)piperidine-4-carboxamide
Compound characteristics
| Compound ID: | L794-0046 |
| Compound Name: | N-[2-(3,4-dimethoxyphenyl)ethyl]-1-(3-oxo-3,4-dihydro-2H-1,4-benzothiazine-2-carbonyl)piperidine-4-carboxamide |
| Molecular Weight: | 483.59 |
| Molecular Formula: | C25 H29 N3 O5 S |
| Smiles: | COc1ccc(CCNC(C2CCN(CC2)C(C2C(Nc3ccccc3S2)=O)=O)=O)cc1OC |
| Stereo: | RACEMIC MIXTURE |
| logP: | 1.5358 |
| logD: | 1.5358 |
| logSw: | -2.4903 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 81.28 |
| InChI Key: | HFAIBYKZPUMPFD-JOCHJYFZSA-N |