3-(2-ethyl-3-oxo-3,4-dihydro-2H-1,4-benzothiazine-6-sulfonyl)-N-(2-phenylpropyl)propanamide
Chemical Structure Depiction of
3-(2-ethyl-3-oxo-3,4-dihydro-2H-1,4-benzothiazine-6-sulfonyl)-N-(2-phenylpropyl)propanamide
3-(2-ethyl-3-oxo-3,4-dihydro-2H-1,4-benzothiazine-6-sulfonyl)-N-(2-phenylpropyl)propanamide
Compound characteristics
| Compound ID: | E589-0949 |
| Compound Name: | 3-(2-ethyl-3-oxo-3,4-dihydro-2H-1,4-benzothiazine-6-sulfonyl)-N-(2-phenylpropyl)propanamide |
| Molecular Weight: | 446.59 |
| Molecular Formula: | C22 H26 N2 O4 S2 |
| Smiles: | CCC1C(Nc2cc(ccc2S1)S(CCC(NCC(C)c1ccccc1)=O)(=O)=O)=O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 3.3925 |
| logD: | 3.3925 |
| logSw: | -3.8264 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 78.352 |
| InChI Key: | QDGPOCQYJUJRJK-UHFFFAOYSA-N |