2-[(5-tert-butyl-2-methylphenyl)sulfanyl]-N-(3-cyano-6-methyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)acetamide
Chemical Structure Depiction of
2-[(5-tert-butyl-2-methylphenyl)sulfanyl]-N-(3-cyano-6-methyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)acetamide
2-[(5-tert-butyl-2-methylphenyl)sulfanyl]-N-(3-cyano-6-methyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)acetamide
Compound characteristics
| Compound ID: | 8014-2847 |
| Compound Name: | 2-[(5-tert-butyl-2-methylphenyl)sulfanyl]-N-(3-cyano-6-methyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)acetamide |
| Molecular Weight: | 412.62 |
| Molecular Formula: | C23 H28 N2 O S2 |
| Smiles: | CC1CCc2c(C#N)c(NC(CSc3cc(ccc3C)C(C)(C)C)=O)sc2C1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 6.5915 |
| logD: | 5.4128 |
| logSw: | -5.6322 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 39.887 |
| InChI Key: | IQPZRBMDZNAYTK-CQSZACIVSA-N |