2-[2-(4-nitrophenyl)acetamido]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide
Chemical Structure Depiction of
2-[2-(4-nitrophenyl)acetamido]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide
2-[2-(4-nitrophenyl)acetamido]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide
Compound characteristics
| Compound ID: | Y203-6280 |
| Compound Name: | 2-[2-(4-nitrophenyl)acetamido]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide |
| Molecular Weight: | 359.4 |
| Molecular Formula: | C17 H17 N3 O4 S |
| Smiles: | C1CCc2c(C1)c(C(N)=O)c(NC(Cc1ccc(cc1)[N+]([O-])=O)=O)s2 |
| Stereo: | ACHIRAL |
| logP: | 1.782 |
| logD: | 1.021 |
| logSw: | -2.5205 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 90.272 |
| InChI Key: | MMBDOZYLAJKSRI-UHFFFAOYSA-N |