2-[2-(3-nitro-1H-pyrazol-1-yl)acetamido]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide
Chemical Structure Depiction of
2-[2-(3-nitro-1H-pyrazol-1-yl)acetamido]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide
2-[2-(3-nitro-1H-pyrazol-1-yl)acetamido]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide
Compound characteristics
| Compound ID: | 8016-6968 |
| Compound Name: | 2-[2-(3-nitro-1H-pyrazol-1-yl)acetamido]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide |
| Molecular Weight: | 349.37 |
| Molecular Formula: | C14 H15 N5 O4 S |
| Smiles: | C1CCc2c(C1)c(C(N)=O)c(NC(Cn1ccc(n1)[N+]([O-])=O)=O)s2 |
| Stereo: | ACHIRAL |
| logP: | 0.2942 |
| logD: | -0.058 |
| logSw: | -2.3877 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 104.395 |
| InChI Key: | DKZXXROGLVJUCE-UHFFFAOYSA-N |