N,N-diethyl-2-(3-oxo-4-{[3-(trifluoromethyl)phenyl]methyl}-3,4-dihydro-2H-1,4-benzothiazin-2-ylidene)acetamide
Chemical Structure Depiction of
N,N-diethyl-2-(3-oxo-4-{[3-(trifluoromethyl)phenyl]methyl}-3,4-dihydro-2H-1,4-benzothiazin-2-ylidene)acetamide
N,N-diethyl-2-(3-oxo-4-{[3-(trifluoromethyl)phenyl]methyl}-3,4-dihydro-2H-1,4-benzothiazin-2-ylidene)acetamide
Compound characteristics
| Compound ID: | V010-7451 |
| Compound Name: | N,N-diethyl-2-(3-oxo-4-{[3-(trifluoromethyl)phenyl]methyl}-3,4-dihydro-2H-1,4-benzothiazin-2-ylidene)acetamide |
| Molecular Weight: | 434.48 |
| Molecular Formula: | C22 H21 F3 N2 O2 S |
| Smiles: | CCN(CC)C(\C=C1/C(N(Cc2cccc(c2)C(F)(F)F)c2ccccc2S1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.8845 |
| logD: | 4.8845 |
| logSw: | -4.6211 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 30.7458 |
| InChI Key: | PSIKAYAKNRSVNM-UHFFFAOYSA-N |