N-(3-cyano-6-ethyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-3,3-dimethylbutanamide
Chemical Structure Depiction of
N-(3-cyano-6-ethyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-3,3-dimethylbutanamide
N-(3-cyano-6-ethyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-3,3-dimethylbutanamide
Compound characteristics
| Compound ID: | Y205-0064 |
| Compound Name: | N-(3-cyano-6-ethyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-3,3-dimethylbutanamide |
| Molecular Weight: | 304.45 |
| Molecular Formula: | C17 H24 N2 O S |
| Smiles: | CCC1CCc2c(C#N)c(NC(CC(C)(C)C)=O)sc2C1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.8617 |
| logD: | 3.1699 |
| logSw: | -4.7038 |
| Hydrogen bond acceptors count: | 3 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 40.159 |
| InChI Key: | RFPRSYJOPSHAEN-LLVKDONJSA-N |