N-[2-(cyclohex-1-en-1-yl)ethyl]-2-(3-oxo-2-{[4-(trifluoromethyl)phenyl]methylidene}-2,3-dihydro-4H-1,4-benzothiazin-4-yl)acetamide
Chemical Structure Depiction of
N-[2-(cyclohex-1-en-1-yl)ethyl]-2-(3-oxo-2-{[4-(trifluoromethyl)phenyl]methylidene}-2,3-dihydro-4H-1,4-benzothiazin-4-yl)acetamide
N-[2-(cyclohex-1-en-1-yl)ethyl]-2-(3-oxo-2-{[4-(trifluoromethyl)phenyl]methylidene}-2,3-dihydro-4H-1,4-benzothiazin-4-yl)acetamide
Compound characteristics
| Compound ID: | C312-1646 |
| Compound Name: | N-[2-(cyclohex-1-en-1-yl)ethyl]-2-(3-oxo-2-{[4-(trifluoromethyl)phenyl]methylidene}-2,3-dihydro-4H-1,4-benzothiazin-4-yl)acetamide |
| Molecular Weight: | 486.56 |
| Molecular Formula: | C26 H25 F3 N2 O2 S |
| Smiles: | C1CCC(CCNC(CN2C(/C(=C\c3ccc(cc3)C(F)(F)F)Sc3ccccc23)=O)=O)=CC1 |
| Stereo: | ACHIRAL |
| logP: | 5.6464 |
| logD: | 5.6464 |
| logSw: | -5.8737 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 39.575 |
| InChI Key: | QUBRBOACSXBEHH-UHFFFAOYSA-N |