methyl 2-(cyclohexylcarbamamido)-6-(2-methylbutan-2-yl)-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
Chemical Structure Depiction of
methyl 2-(cyclohexylcarbamamido)-6-(2-methylbutan-2-yl)-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
methyl 2-(cyclohexylcarbamamido)-6-(2-methylbutan-2-yl)-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
Compound characteristics
| Compound ID: | Y203-9761 |
| Compound Name: | methyl 2-(cyclohexylcarbamamido)-6-(2-methylbutan-2-yl)-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate |
| Molecular Weight: | 406.59 |
| Molecular Formula: | C22 H34 N2 O3 S |
| Smiles: | CCC(C)(C)C1CCc2c(C(=O)OC)c(NC(NC3CCCCC3)=O)sc2C1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 5.3956 |
| logD: | 4.7132 |
| logSw: | -5.1983 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 54.478 |
| InChI Key: | NJJSZERCNRJVGR-CQSZACIVSA-N |