N-[3-(butylsulfanyl)propyl]-2-(3-oxo-3,4-dihydro-2H-1,4-benzothiazin-2-ylidene)acetamide
Chemical Structure Depiction of
N-[3-(butylsulfanyl)propyl]-2-(3-oxo-3,4-dihydro-2H-1,4-benzothiazin-2-ylidene)acetamide
N-[3-(butylsulfanyl)propyl]-2-(3-oxo-3,4-dihydro-2H-1,4-benzothiazin-2-ylidene)acetamide
Compound characteristics
| Compound ID: | K788-1177 |
| Compound Name: | N-[3-(butylsulfanyl)propyl]-2-(3-oxo-3,4-dihydro-2H-1,4-benzothiazin-2-ylidene)acetamide |
| Molecular Weight: | 350.5 |
| Molecular Formula: | C17 H22 N2 O2 S2 |
| Smiles: | CCCCSCCCNC(/C=C1/C(Nc2ccccc2S1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.0676 |
| logD: | 3.0676 |
| logSw: | -3.3766 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 49.429 |
| InChI Key: | KPKZQTUTICWYEG-UHFFFAOYSA-N |