N-(2,5-dimethoxyphenyl)-1-(3-oxo-3,4-dihydro-2H-1,4-benzothiazine-6-sulfonyl)piperidine-4-carboxamide
Chemical Structure Depiction of
N-(2,5-dimethoxyphenyl)-1-(3-oxo-3,4-dihydro-2H-1,4-benzothiazine-6-sulfonyl)piperidine-4-carboxamide
N-(2,5-dimethoxyphenyl)-1-(3-oxo-3,4-dihydro-2H-1,4-benzothiazine-6-sulfonyl)piperidine-4-carboxamide
Compound characteristics
| Compound ID: | E959-1557 |
| Compound Name: | N-(2,5-dimethoxyphenyl)-1-(3-oxo-3,4-dihydro-2H-1,4-benzothiazine-6-sulfonyl)piperidine-4-carboxamide |
| Molecular Weight: | 491.58 |
| Molecular Formula: | C22 H25 N3 O6 S2 |
| Smiles: | COc1ccc(c(c1)NC(C1CCN(CC1)S(c1ccc2c(c1)NC(CS2)=O)(=O)=O)=O)OC |
| Stereo: | ACHIRAL |
| logP: | 2.0411 |
| logD: | 2.0386 |
| logSw: | -2.9197 |
| Hydrogen bond acceptors count: | 12 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 94.338 |
| InChI Key: | LCXAKTNTSZEXPZ-UHFFFAOYSA-N |