6-chloro-2-(pyrrolidine-1-carbonyl)-4-[3-(trifluoromethyl)phenyl]-1lambda~6~,4-benzothiazine-1,1(4H)-dione
Chemical Structure Depiction of
6-chloro-2-(pyrrolidine-1-carbonyl)-4-[3-(trifluoromethyl)phenyl]-1lambda~6~,4-benzothiazine-1,1(4H)-dione
6-chloro-2-(pyrrolidine-1-carbonyl)-4-[3-(trifluoromethyl)phenyl]-1lambda~6~,4-benzothiazine-1,1(4H)-dione
Compound characteristics
| Compound ID: | L810-0517 |
| Compound Name: | 6-chloro-2-(pyrrolidine-1-carbonyl)-4-[3-(trifluoromethyl)phenyl]-1lambda~6~,4-benzothiazine-1,1(4H)-dione |
| Molecular Weight: | 456.87 |
| Molecular Formula: | C20 H16 Cl F3 N2 O3 S |
| Smiles: | C1CCN(C1)C(C1=CN(c2cccc(c2)C(F)(F)F)c2cc(ccc2S1(=O)=O)[Cl])=O |
| Stereo: | ACHIRAL |
| logP: | 3.7446 |
| logD: | 3.7446 |
| logSw: | -4.2641 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 47.965 |
| InChI Key: | KPXLGJPRTXUDRZ-UHFFFAOYSA-N |