2-[2-(azepane-1-carbonyl)-3-oxo-2,3-dihydro-4H-1,4-benzothiazin-4-yl]-N-[3-(trifluoromethyl)phenyl]acetamide
Chemical Structure Depiction of
2-[2-(azepane-1-carbonyl)-3-oxo-2,3-dihydro-4H-1,4-benzothiazin-4-yl]-N-[3-(trifluoromethyl)phenyl]acetamide
2-[2-(azepane-1-carbonyl)-3-oxo-2,3-dihydro-4H-1,4-benzothiazin-4-yl]-N-[3-(trifluoromethyl)phenyl]acetamide
Compound characteristics
| Compound ID: | L592-1978 |
| Compound Name: | 2-[2-(azepane-1-carbonyl)-3-oxo-2,3-dihydro-4H-1,4-benzothiazin-4-yl]-N-[3-(trifluoromethyl)phenyl]acetamide |
| Molecular Weight: | 491.53 |
| Molecular Formula: | C24 H24 F3 N3 O3 S |
| Smiles: | C1CCCN(CC1)C(C1C(N(CC(Nc2cccc(c2)C(F)(F)F)=O)c2ccccc2S1)=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.6876 |
| logD: | 4.6867 |
| logSw: | -4.5083 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 55.47 |
| InChI Key: | PSQDMSRSGAHYBG-NRFANRHFSA-N |