N-[3-(methylsulfanyl)phenyl]-6,7,8,9-tetrahydro-1H-thiopyrano[4,3-b][1]benzothiophene-3-carboxamide
Chemical Structure Depiction of
N-[3-(methylsulfanyl)phenyl]-6,7,8,9-tetrahydro-1H-thiopyrano[4,3-b][1]benzothiophene-3-carboxamide
N-[3-(methylsulfanyl)phenyl]-6,7,8,9-tetrahydro-1H-thiopyrano[4,3-b][1]benzothiophene-3-carboxamide
Compound characteristics
| Compound ID: | E722-2554 |
| Compound Name: | N-[3-(methylsulfanyl)phenyl]-6,7,8,9-tetrahydro-1H-thiopyrano[4,3-b][1]benzothiophene-3-carboxamide |
| Molecular Weight: | 373.56 |
| Molecular Formula: | C19 H19 N O S3 |
| Smiles: | CSc1cccc(c1)NC(C1=Cc2c(CS1)c1CCCCc1s2)=O |
| Stereo: | ACHIRAL |
| logP: | 5.5587 |
| logD: | 5.5587 |
| logSw: | -5.3281 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 24.1892 |
| InChI Key: | FQEXDXAVLFWPMF-UHFFFAOYSA-N |