AC1LZJO5
N-(4-chlorophenyl)-2-[(7-ethyl-8-oxo-16-thia-2,4,5,7-tetrazatetracyclo[7.7.0.02,6.010,15]hexadeca-1(9),3,5,10(15)-tetraen-3-yl)sulfanyl]acetamide
Also Known As: CBKinase1_009416|CBKinase1_021816|BRD-K75461261-001-01-1|N-(4-chlorophenyl)-2-((4-ethyl-5-oxo-4,5,6,7,8,9-hexahydrobenzo[4,5]thieno[3,2-e][1,2,4]triazolo[4,3-a]pyrimidin-1-yl)thio)acetamide|N-(4-chlorophenyl)-2-[(4-ethyl-5-oxo-4,5,6,7,8,9-hexahydro[1]benzothieno[3,2-e][1,2,4]triazolo[4,3-a]pyrimidin-1-yl)sulfanyl]acetamide
| Molecular Formula | C21H20ClN5O2S2 |
|---|---|
| Molecular Weight | 473.0747 g/mol |
| LogP | 4.3886 |
| Topological Polar Surface Area | 81.29 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 5 |
| Exact Mass | 473.0747 |
| Monoisotopic Mass | 473.0747 |
| Heavy Atoms | 31 |
| Complexity | 1356.6064 |
Chemical Identifiers
| CAS Number | 577985-91-2 |
|---|---|
| SMILES | CCN1C(=O)C2=C(N3C1=NN=C3SCC(=O)NC4=CC=C(C=C4)Cl)SC5=C2CCCC5 |
Product Overview
AC1LZJO5 (CAS 577985-91-2), with molecular formula C21H20ClN5O2S2 and molecular weight 473.0747 g/mol. IUPAC: N-(4-chlorophenyl)-2-[(7-ethyl-8-oxo-16-thia-2,4,5,7-tetrazatetracyclo[7.7.0.02,6.010,15]hexadeca-1(9),3,5,10(15)-tetraen-3-yl)sulfanyl]acetamide.
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