N-(3-cyano-6-ethyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-2-[(pyrimidin-2-yl)sulfanyl]acetamide
Chemical Structure Depiction of
N-(3-cyano-6-ethyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-2-[(pyrimidin-2-yl)sulfanyl]acetamide
N-(3-cyano-6-ethyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-2-[(pyrimidin-2-yl)sulfanyl]acetamide
Compound characteristics
| Compound ID: | Y203-3533 |
| Compound Name: | N-(3-cyano-6-ethyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-2-[(pyrimidin-2-yl)sulfanyl]acetamide |
| Molecular Weight: | 358.48 |
| Molecular Formula: | C17 H18 N4 O S2 |
| Smiles: | CCC1CCc2c(C#N)c(NC(CSc3ncccn3)=O)sc2C1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.4474 |
| logD: | 2.4146 |
| logSw: | -3.892 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 58.045 |
| InChI Key: | KPLUCSNYHYCLQG-LLVKDONJSA-N |