N-(3-benzoyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-4-nitrobenzamide
Chemical Structure Depiction of
N-(3-benzoyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-4-nitrobenzamide
N-(3-benzoyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-4-nitrobenzamide
Compound characteristics
| Compound ID: | 8755-0335 |
| Compound Name: | N-(3-benzoyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-4-nitrobenzamide |
| Molecular Weight: | 406.46 |
| Molecular Formula: | C22 H18 N2 O4 S |
| Smiles: | C1CCc2c(C1)c(C(c1ccccc1)=O)c(NC(c1ccc(cc1)[N+]([O-])=O)=O)s2 |
| Stereo: | ACHIRAL |
| logP: | 5.0438 |
| logD: | 3.5204 |
| logSw: | -5.0779 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 69.893 |
| InChI Key: | FDKOBJYWDHAPNM-UHFFFAOYSA-N |