N-[3-cyano-6-(2-methylbutan-2-yl)-4,5,6,7-tetrahydro-1-benzothiophen-2-yl]-2-ethylbutanamide
Chemical Structure Depiction of
N-[3-cyano-6-(2-methylbutan-2-yl)-4,5,6,7-tetrahydro-1-benzothiophen-2-yl]-2-ethylbutanamide
N-[3-cyano-6-(2-methylbutan-2-yl)-4,5,6,7-tetrahydro-1-benzothiophen-2-yl]-2-ethylbutanamide
Compound characteristics
| Compound ID: | Y500-7834 |
| Compound Name: | N-[3-cyano-6-(2-methylbutan-2-yl)-4,5,6,7-tetrahydro-1-benzothiophen-2-yl]-2-ethylbutanamide |
| Molecular Weight: | 346.53 |
| Molecular Formula: | C20 H30 N2 O S |
| Smiles: | CCC(CC)C(Nc1c(C#N)c2CCC(Cc2s1)C(C)(C)CC)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 5.2387 |
| logD: | 3.4914 |
| logSw: | -4.9679 |
| Hydrogen bond acceptors count: | 3 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 40.372 |
| InChI Key: | SWIBDWBSJSJQHL-CQSZACIVSA-N |