N-(3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-2-[(4,6-diphenylpyrimidin-2-yl)sulfanyl]acetamide
Chemical Structure Depiction of
N-(3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-2-[(4,6-diphenylpyrimidin-2-yl)sulfanyl]acetamide
N-(3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-2-[(4,6-diphenylpyrimidin-2-yl)sulfanyl]acetamide
Compound characteristics
| Compound ID: | 8009-2567 |
| Compound Name: | N-(3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-2-[(4,6-diphenylpyrimidin-2-yl)sulfanyl]acetamide |
| Molecular Weight: | 482.63 |
| Molecular Formula: | C27 H22 N4 O S2 |
| Smiles: | C1CCc2c(C1)c(C#N)c(NC(CSc1nc(cc(c3ccccc3)n1)c1ccccc1)=O)s2 |
| Stereo: | ACHIRAL |
| logP: | 6.8474 |
| logD: | 5.8147 |
| logSw: | -6.0391 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 56.638 |
| InChI Key: | DJZBLGXOCROOSG-UHFFFAOYSA-N |