6-(2-methylbutan-2-yl)-2-(2-nitrobenzamido)-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide
Chemical Structure Depiction of
6-(2-methylbutan-2-yl)-2-(2-nitrobenzamido)-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide
6-(2-methylbutan-2-yl)-2-(2-nitrobenzamido)-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide
Compound characteristics
| Compound ID: | Y203-7738 |
| Compound Name: | 6-(2-methylbutan-2-yl)-2-(2-nitrobenzamido)-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide |
| Molecular Weight: | 415.51 |
| Molecular Formula: | C21 H25 N3 O4 S |
| Smiles: | CCC(C)(C)C1CCc2c(C(N)=O)c(NC(c3ccccc3[N+]([O-])=O)=O)sc2C1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.1488 |
| logD: | -0.865 |
| logSw: | -3.7963 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 90.184 |
| InChI Key: | AHWBGNKFVPOBMC-GFCCVEGCSA-N |