3-(2-ethyl-3-oxo-3,4-dihydro-2H-1,4-benzothiazine-6-sulfonyl)-N-[(4-fluorophenyl)methyl]propanamide
Chemical Structure Depiction of
3-(2-ethyl-3-oxo-3,4-dihydro-2H-1,4-benzothiazine-6-sulfonyl)-N-[(4-fluorophenyl)methyl]propanamide
3-(2-ethyl-3-oxo-3,4-dihydro-2H-1,4-benzothiazine-6-sulfonyl)-N-[(4-fluorophenyl)methyl]propanamide
Compound characteristics
| Compound ID: | E589-0943 |
| Compound Name: | 3-(2-ethyl-3-oxo-3,4-dihydro-2H-1,4-benzothiazine-6-sulfonyl)-N-[(4-fluorophenyl)methyl]propanamide |
| Molecular Weight: | 436.52 |
| Molecular Formula: | C20 H21 F N2 O4 S2 |
| Smiles: | CCC1C(Nc2cc(ccc2S1)S(CCC(NCc1ccc(cc1)F)=O)(=O)=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.577 |
| logD: | 2.5769 |
| logSw: | -3.0127 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 78.352 |
| InChI Key: | KVZISKKLUJPXIN-QGZVFWFLSA-N |