N-(3-nitrophenyl)-4,5,6,7-tetrahydro-2-benzothiophene-1-carboxamide
Chemical Structure Depiction of
N-(3-nitrophenyl)-4,5,6,7-tetrahydro-2-benzothiophene-1-carboxamide
N-(3-nitrophenyl)-4,5,6,7-tetrahydro-2-benzothiophene-1-carboxamide
Compound characteristics
| Compound ID: | 8012-7731 |
| Compound Name: | N-(3-nitrophenyl)-4,5,6,7-tetrahydro-2-benzothiophene-1-carboxamide |
| Molecular Weight: | 302.35 |
| Molecular Formula: | C15 H14 N2 O3 S |
| Smiles: | C1CCc2c(C1)csc2C(Nc1cccc(c1)[N+]([O-])=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.9879 |
| logD: | 3.9802 |
| logSw: | -4.2551 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 57.65 |
| InChI Key: | BVGSGHKYQOLRGN-UHFFFAOYSA-N |