N-[2-(3,4-dimethoxyphenyl)ethyl]-2-{2-[(2-fluorophenyl)methylidene]-3-oxo-2,3-dihydro-4H-1,4-benzothiazin-4-yl}acetamide
Chemical Structure Depiction of
N-[2-(3,4-dimethoxyphenyl)ethyl]-2-{2-[(2-fluorophenyl)methylidene]-3-oxo-2,3-dihydro-4H-1,4-benzothiazin-4-yl}acetamide
N-[2-(3,4-dimethoxyphenyl)ethyl]-2-{2-[(2-fluorophenyl)methylidene]-3-oxo-2,3-dihydro-4H-1,4-benzothiazin-4-yl}acetamide
Compound characteristics
| Compound ID: | C312-0447 |
| Compound Name: | N-[2-(3,4-dimethoxyphenyl)ethyl]-2-{2-[(2-fluorophenyl)methylidene]-3-oxo-2,3-dihydro-4H-1,4-benzothiazin-4-yl}acetamide |
| Molecular Weight: | 492.57 |
| Molecular Formula: | C27 H25 F N2 O4 S |
| Smiles: | COc1ccc(CCNC(CN2C(/C(=C/c3ccccc3F)Sc3ccccc23)=O)=O)cc1OC |
| Stereo: | ACHIRAL |
| logP: | 4.1163 |
| logD: | 4.1163 |
| logSw: | -4.2522 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 54.643 |
| InChI Key: | VYFLMOKBTHGDIO-UHFFFAOYSA-N |