2-(2-nitrobenzamido)-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide
Chemical Structure Depiction of
2-(2-nitrobenzamido)-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide
2-(2-nitrobenzamido)-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide
Compound characteristics
| Compound ID: | 1000-0685 |
| Compound Name: | 2-(2-nitrobenzamido)-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide |
| Molecular Weight: | 345.37 |
| Molecular Formula: | C16 H15 N3 O4 S |
| Smiles: | C1CCc2c(C1)c(C(N)=O)c(NC(c1ccccc1[N+]([O-])=O)=O)s2 |
| Stereo: | ACHIRAL |
| logP: | 1.683 |
| logD: | -2.3307 |
| logSw: | -2.7382 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 90.184 |
| InChI Key: | YVFSXNWSBGMSSC-UHFFFAOYSA-N |