4-[3-(methylsulfanyl)phenyl]-2-(piperidine-1-carbonyl)-1lambda~6~,4-benzothiazine-1,1(4H)-dione
Chemical Structure Depiction of
4-[3-(methylsulfanyl)phenyl]-2-(piperidine-1-carbonyl)-1lambda~6~,4-benzothiazine-1,1(4H)-dione
4-[3-(methylsulfanyl)phenyl]-2-(piperidine-1-carbonyl)-1lambda~6~,4-benzothiazine-1,1(4H)-dione
Compound characteristics
| Compound ID: | L810-0078 |
| Compound Name: | 4-[3-(methylsulfanyl)phenyl]-2-(piperidine-1-carbonyl)-1lambda~6~,4-benzothiazine-1,1(4H)-dione |
| Molecular Weight: | 414.54 |
| Molecular Formula: | C21 H22 N2 O3 S2 |
| Smiles: | CSc1cccc(c1)N1C=C(C(N2CCCCC2)=O)S(c2ccccc12)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.8619 |
| logD: | 2.8619 |
| logSw: | -3.5747 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 47.599 |
| InChI Key: | LTKCQOUDTMHJRJ-UHFFFAOYSA-N |