3-(2-ethyl-3-oxo-3,4-dihydro-2H-1,4-benzothiazine-6-sulfonyl)-N-[(oxolan-2-yl)methyl]propanamide
Chemical Structure Depiction of
3-(2-ethyl-3-oxo-3,4-dihydro-2H-1,4-benzothiazine-6-sulfonyl)-N-[(oxolan-2-yl)methyl]propanamide
3-(2-ethyl-3-oxo-3,4-dihydro-2H-1,4-benzothiazine-6-sulfonyl)-N-[(oxolan-2-yl)methyl]propanamide
Compound characteristics
| Compound ID: | E589-0922 |
| Compound Name: | 3-(2-ethyl-3-oxo-3,4-dihydro-2H-1,4-benzothiazine-6-sulfonyl)-N-[(oxolan-2-yl)methyl]propanamide |
| Molecular Weight: | 412.53 |
| Molecular Formula: | C18 H24 N2 O5 S2 |
| Smiles: | CCC1C(Nc2cc(ccc2S1)S(CCC(NCC1CCCO1)=O)(=O)=O)=O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 1.0034 |
| logD: | 1.0034 |
| logSw: | -2.2305 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 87.007 |
| InChI Key: | FNEHJGGXNBTAOG-UHFFFAOYSA-N |