2-(4-methyl-3-nitrobenzamido)-6-propyl-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide
Chemical Structure Depiction of
2-(4-methyl-3-nitrobenzamido)-6-propyl-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide
2-(4-methyl-3-nitrobenzamido)-6-propyl-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide
Compound characteristics
| Compound ID: | Y203-7151 |
| Compound Name: | 2-(4-methyl-3-nitrobenzamido)-6-propyl-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide |
| Molecular Weight: | 401.48 |
| Molecular Formula: | C20 H23 N3 O4 S |
| Smiles: | CCCC1CCc2c(C(N)=O)c(NC(c3ccc(C)c(c3)[N+]([O-])=O)=O)sc2C1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.7553 |
| logD: | 0.9523 |
| logSw: | -4.4989 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 90.184 |
| InChI Key: | WWUZEGMSIIDGCM-GFCCVEGCSA-N |