N-[3-(butylsulfanyl)propyl]-2-{2-[(4-methoxyphenyl)methylidene]-3-oxo-2,3-dihydro-4H-1,4-benzothiazin-4-yl}acetamide
Chemical Structure Depiction of
N-[3-(butylsulfanyl)propyl]-2-{2-[(4-methoxyphenyl)methylidene]-3-oxo-2,3-dihydro-4H-1,4-benzothiazin-4-yl}acetamide
N-[3-(butylsulfanyl)propyl]-2-{2-[(4-methoxyphenyl)methylidene]-3-oxo-2,3-dihydro-4H-1,4-benzothiazin-4-yl}acetamide
Compound characteristics
| Compound ID: | K788-1442 |
| Compound Name: | N-[3-(butylsulfanyl)propyl]-2-{2-[(4-methoxyphenyl)methylidene]-3-oxo-2,3-dihydro-4H-1,4-benzothiazin-4-yl}acetamide |
| Molecular Weight: | 470.65 |
| Molecular Formula: | C25 H30 N2 O3 S2 |
| Smiles: | CCCCSCCCNC(CN1C(/C(=C/c2ccc(cc2)OC)Sc2ccccc12)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.9179 |
| logD: | 4.9179 |
| logSw: | -4.4828 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 47.198 |
| InChI Key: | JXMLVPFAIZAHJN-UHFFFAOYSA-N |