N-(2,2-dimethoxyethyl)-2-(3-oxo-2-{[4-(trifluoromethyl)phenyl]methylidene}-2,3-dihydro-4H-1,4-benzothiazin-4-yl)acetamide
Chemical Structure Depiction of
N-(2,2-dimethoxyethyl)-2-(3-oxo-2-{[4-(trifluoromethyl)phenyl]methylidene}-2,3-dihydro-4H-1,4-benzothiazin-4-yl)acetamide
N-(2,2-dimethoxyethyl)-2-(3-oxo-2-{[4-(trifluoromethyl)phenyl]methylidene}-2,3-dihydro-4H-1,4-benzothiazin-4-yl)acetamide
Compound characteristics
| Compound ID: | C312-1636 |
| Compound Name: | N-(2,2-dimethoxyethyl)-2-(3-oxo-2-{[4-(trifluoromethyl)phenyl]methylidene}-2,3-dihydro-4H-1,4-benzothiazin-4-yl)acetamide |
| Molecular Weight: | 466.48 |
| Molecular Formula: | C22 H21 F3 N2 O4 S |
| Smiles: | COC(CNC(CN1C(/C(=C\c2ccc(cc2)C(F)(F)F)Sc2ccccc12)=O)=O)OC |
| Stereo: | ACHIRAL |
| logP: | 3.4548 |
| logD: | 3.4548 |
| logSw: | -3.8807 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 55.307 |
| InChI Key: | QMWVXOBLMXBPOC-UHFFFAOYSA-N |