N-[(4-methylphenyl)methyl]-6,7,8,9-tetrahydro-1H-thiopyrano[4,3-b][1]benzothiophene-3-carboxamide
Chemical Structure Depiction of
N-[(4-methylphenyl)methyl]-6,7,8,9-tetrahydro-1H-thiopyrano[4,3-b][1]benzothiophene-3-carboxamide
N-[(4-methylphenyl)methyl]-6,7,8,9-tetrahydro-1H-thiopyrano[4,3-b][1]benzothiophene-3-carboxamide
Compound characteristics
| Compound ID: | E722-2520 |
| Compound Name: | N-[(4-methylphenyl)methyl]-6,7,8,9-tetrahydro-1H-thiopyrano[4,3-b][1]benzothiophene-3-carboxamide |
| Molecular Weight: | 355.52 |
| Molecular Formula: | C20 H21 N O S2 |
| Smiles: | Cc1ccc(CNC(C2=Cc3c(CS2)c2CCCCc2s3)=O)cc1 |
| Stereo: | ACHIRAL |
| logP: | 5.1939 |
| logD: | 5.1939 |
| logSw: | -5.0225 |
| Hydrogen bond acceptors count: | 3 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 25.5113 |
| InChI Key: | ZQYLPRBPVPZPQP-UHFFFAOYSA-N |