CBKinase1_001539
2-[[3-cyano-4-(furan-2-yl)-5,6,7,8-tetrahydroquinolin-2-yl]sulfanyl]-N-(2,4,6-trimethylphenyl)acetamide
Also Known As: CBKinase1_001539|CBKinase1_013939|Oprea1_758007|AE-848/15116487|2-[[3-cyano-4-(furan-2-yl)-5,6,7,8-tetrahydroquinolin-2-yl]sulfanyl]-N-(2,4,6-trimethylphenyl)acetamide|SR-01000484773-1|2-{[3-cyano-4-(2-furyl)-5,6,7,8-tetrahydroquinolin-2-yl]sulfanyl}-N-mesitylacetamide|BRD-K18860696-001-01-9|2-{[3-cyano-4-(furan-2-yl)-5,6,7,8-tetrahydroquinolin-2-yl]sulfanyl}-N-(2,4,6-trimethylphenyl)acetamide|2-((3-cyano-4-(furan-2-yl)-5,6,7,8-tetrahydroquinolin-2-yl)thio)-N-mesitylacetamide
| Molecular Formula | C25H25N3O2S |
|---|---|
| Molecular Weight | 431.16675 g/mol |
| LogP | 5.74814 |
| Topological Polar Surface Area | 78.92 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 5 |
| Exact Mass | 431.16675 |
| Monoisotopic Mass | 431.16675 |
| Heavy Atoms | 31 |
| Complexity | 1153.4583 |
Chemical Identifiers
| CAS Number | 370855-13-3 |
|---|---|
| SMILES | CC1=CC(=C(C(=C1)C)NC(=O)CSC2=NC3=C(CCCC3)C(=C2C#N)C4=CC=CO4)C |
Product Overview
CBKinase1_001539 (CAS 370855-13-3), with molecular formula C25H25N3O2S and molecular weight 431.16675 g/mol. IUPAC: 2-[[3-cyano-4-(furan-2-yl)-5,6,7,8-tetrahydroquinolin-2-yl]sulfanyl]-N-(2,4,6-trimethylphenyl)acetamide.
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