2-(pyrrolidine-1-carbonyl)-4-[4-(trifluoromethyl)phenyl]-1lambda~6~,4-benzothiazine-1,1(4H)-dione
Chemical Structure Depiction of
2-(pyrrolidine-1-carbonyl)-4-[4-(trifluoromethyl)phenyl]-1lambda~6~,4-benzothiazine-1,1(4H)-dione
2-(pyrrolidine-1-carbonyl)-4-[4-(trifluoromethyl)phenyl]-1lambda~6~,4-benzothiazine-1,1(4H)-dione
Compound characteristics
| Compound ID: | L810-0048 |
| Compound Name: | 2-(pyrrolidine-1-carbonyl)-4-[4-(trifluoromethyl)phenyl]-1lambda~6~,4-benzothiazine-1,1(4H)-dione |
| Molecular Weight: | 422.42 |
| Molecular Formula: | C20 H17 F3 N2 O3 S |
| Smiles: | C1CCN(C1)C(C1=CN(c2ccc(cc2)C(F)(F)F)c2ccccc2S1(=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.0039 |
| logD: | 3.0039 |
| logSw: | -3.5585 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 47.965 |
| InChI Key: | XZADCGYCNDCEQK-UHFFFAOYSA-N |