2-(2-chloro-5-nitrobenzamido)-6-methyl-N-(naphthalen-1-yl)-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide
Chemical Structure Depiction of
2-(2-chloro-5-nitrobenzamido)-6-methyl-N-(naphthalen-1-yl)-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide
2-(2-chloro-5-nitrobenzamido)-6-methyl-N-(naphthalen-1-yl)-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide
Compound characteristics
| Compound ID: | 3261-0933 |
| Compound Name: | 2-(2-chloro-5-nitrobenzamido)-6-methyl-N-(naphthalen-1-yl)-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide |
| Molecular Weight: | 520.01 |
| Molecular Formula: | C27 H22 Cl N3 O4 S |
| Smiles: | CC1CCc2c(C(Nc3cccc4ccccc34)=O)c(NC(c3cc(ccc3[Cl])[N+]([O-])=O)=O)sc2C1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 6.7152 |
| logD: | 3.5669 |
| logSw: | -6.6804 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 78.548 |
| InChI Key: | CCTNQUHQPOOSKG-OAHLLOKOSA-N |