(3-oxo-2-{[4-(trifluoromethyl)phenyl]methylidene}-2,3-dihydro-4H-1,4-benzothiazin-4-yl)acetic acid
Chemical Structure Depiction of
(3-oxo-2-{[4-(trifluoromethyl)phenyl]methylidene}-2,3-dihydro-4H-1,4-benzothiazin-4-yl)acetic acid
(3-oxo-2-{[4-(trifluoromethyl)phenyl]methylidene}-2,3-dihydro-4H-1,4-benzothiazin-4-yl)acetic acid
Compound characteristics
| Compound ID: | K783-5310 |
| Compound Name: | (3-oxo-2-{[4-(trifluoromethyl)phenyl]methylidene}-2,3-dihydro-4H-1,4-benzothiazin-4-yl)acetic acid |
| Molecular Weight: | 379.36 |
| Molecular Formula: | C18 H12 F3 N O3 S |
| Smiles: | C(C(O)=O)N1C(/C(=C\c2ccc(cc2)C(F)(F)F)Sc2ccccc12)=O |
| Stereo: | ACHIRAL |
| logP: | 3.3545 |
| logD: | -0.6708 |
| logSw: | -3.6396 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 43.725 |
| InChI Key: | TULYVIWNBQDZBU-UHFFFAOYSA-N |