N-(4-acetylphenyl)-7-methyl-6,7,8,9-tetrahydro-1H-thiopyrano[4,3-b][1]benzothiophene-3-carboxamide
Chemical Structure Depiction of
N-(4-acetylphenyl)-7-methyl-6,7,8,9-tetrahydro-1H-thiopyrano[4,3-b][1]benzothiophene-3-carboxamide
N-(4-acetylphenyl)-7-methyl-6,7,8,9-tetrahydro-1H-thiopyrano[4,3-b][1]benzothiophene-3-carboxamide
Compound characteristics
| Compound ID: | E722-3325 |
| Compound Name: | N-(4-acetylphenyl)-7-methyl-6,7,8,9-tetrahydro-1H-thiopyrano[4,3-b][1]benzothiophene-3-carboxamide |
| Molecular Weight: | 383.53 |
| Molecular Formula: | C21 H21 N O2 S2 |
| Smiles: | CC1CCc2c3CSC(=Cc3sc2C1)C(Nc1ccc(cc1)C(C)=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 5.0738 |
| logD: | 5.0737 |
| logSw: | -4.6414 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 38.016 |
| InChI Key: | AUXKOOOXSIVFDI-GFCCVEGCSA-N |