N-(6-tert-butyl-3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-3-cyclopentylpropanamide
Chemical Structure Depiction of
N-(6-tert-butyl-3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-3-cyclopentylpropanamide
N-(6-tert-butyl-3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-3-cyclopentylpropanamide
Compound characteristics
| Compound ID: | Y501-0503 |
| Compound Name: | N-(6-tert-butyl-3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-3-cyclopentylpropanamide |
| Molecular Weight: | 358.55 |
| Molecular Formula: | C21 H30 N2 O S |
| Smiles: | CC(C)(C)C1CCc2c(C#N)c(NC(CCC3CCCC3)=O)sc2C1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 5.6828 |
| logD: | 4.3696 |
| logSw: | -5.3656 |
| Hydrogen bond acceptors count: | 3 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 40.445 |
| InChI Key: | SHNDVJHOCZDQRG-OAHLLOKOSA-N |