4-(4-chloro-2-methylphenoxy)-N-[3-cyano-6-(2-methylbutan-2-yl)-4,5,6,7-tetrahydro-1-benzothiophen-2-yl]butanamide
Chemical Structure Depiction of
4-(4-chloro-2-methylphenoxy)-N-[3-cyano-6-(2-methylbutan-2-yl)-4,5,6,7-tetrahydro-1-benzothiophen-2-yl]butanamide
4-(4-chloro-2-methylphenoxy)-N-[3-cyano-6-(2-methylbutan-2-yl)-4,5,6,7-tetrahydro-1-benzothiophen-2-yl]butanamide
Compound characteristics
| Compound ID: | 3365-7859 |
| Compound Name: | 4-(4-chloro-2-methylphenoxy)-N-[3-cyano-6-(2-methylbutan-2-yl)-4,5,6,7-tetrahydro-1-benzothiophen-2-yl]butanamide |
| Molecular Weight: | 459.05 |
| Molecular Formula: | C25 H31 Cl N2 O2 S |
| Smiles: | CCC(C)(C)C1CCc2c(C#N)c(NC(CCCOc3ccc(cc3C)[Cl])=O)sc2C1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 6.8261 |
| logD: | 5.5129 |
| logSw: | -6.4519 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 47.392 |
| InChI Key: | ZTHZGYDHQBQTSG-QGZVFWFLSA-N |