CBKinase1_007601
N-(3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-2-[[5-(7-methoxy-1-benzofuran-2-yl)-4-methyl-1,2,4-triazol-3-yl]sulfanyl]acetamide
Also Known As: CBKinase1_007601|CBKinase1_020001|BRD-K03943546-001-01-2|N-(3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-2-[[5-(7-methoxy-1-benzofuran-2-yl)-4-methyl-1,2,4-triazol-3-yl]sulfanyl]acetamide|N-(3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-2-{[5-(7-methoxy-1-benzofuran-2-yl)-4-methyl-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide
| Molecular Formula | C23H21N5O3S2 |
|---|---|
| Molecular Weight | 479.10858 g/mol |
| LogP | 4.77968 |
| Topological Polar Surface Area | 105.97 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 6 |
| Exact Mass | 479.10858 |
| Monoisotopic Mass | 479.10858 |
| Heavy Atoms | 33 |
| Complexity | 1395.2292 |
Chemical Identifiers
| CAS Number | 708249-39-2 |
|---|---|
| SMILES | CN1C(=NN=C1SCC(=O)NC2=C(C3=C(S2)CCCC3)C#N)C4=CC5=C(O4)C(=CC=C5)OC |
Product Overview
CBKinase1_007601 (CAS 708249-39-2), with molecular formula C23H21N5O3S2 and molecular weight 479.10858 g/mol. IUPAC: N-(3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-2-[[5-(7-methoxy-1-benzofuran-2-yl)-4-methyl-1,2,4-triazol-3-yl]sulfanyl]acetamide.
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