1,1-dioxo-4-[3-(trifluoromethyl)phenyl]-1,4-dihydro-1lambda~6~,4-benzothiazine-2-carbonitrile
Chemical Structure Depiction of
1,1-dioxo-4-[3-(trifluoromethyl)phenyl]-1,4-dihydro-1lambda~6~,4-benzothiazine-2-carbonitrile
1,1-dioxo-4-[3-(trifluoromethyl)phenyl]-1,4-dihydro-1lambda~6~,4-benzothiazine-2-carbonitrile
Compound characteristics
| Compound ID: | L807-0072 |
| Compound Name: | 1,1-dioxo-4-[3-(trifluoromethyl)phenyl]-1,4-dihydro-1lambda~6~,4-benzothiazine-2-carbonitrile |
| Molecular Weight: | 350.32 |
| Molecular Formula: | C16 H9 F3 N2 O2 S |
| Smiles: | C1=C(C#N)S(c2ccccc2N1c1cccc(c1)C(F)(F)F)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.7443 |
| logD: | 2.7443 |
| logSw: | -3.3599 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 48.007 |
| InChI Key: | LJIVVCYSAVZMSL-UHFFFAOYSA-N |