AC1OB68D
3,4-dichloro-N-[(E)-[4-methoxy-3-(thiomorpholin-4-ylmethyl)phenyl]methylideneamino]-1-benzothiophene-2-carboxamide
Also Known As: AK-968/15604846|3,4-dichloro-N-[(E)-[4-methoxy-3-(thiomorpholin-4-ylmethyl)phenyl]methylideneamino]-1-benzothiophene-2-carboxamide|3,4-dichloro-N'-[4-methoxy-3-(4-thiomorpholinylmethyl)benzylidene]-1-benzothiophene-2-carbohydrazide|3,4-dichloro-N'-{(E)-[4-methoxy-3-(thiomorpholin-4-ylmethyl)phenyl]methylidene}-1-benzothiophene-2-carbohydrazide|N-{(1E)-2-[4-methoxy-3-(1,4-thiazaperhydroin-4-ylmethyl)phenyl]-1-azavinyl}(3, 4-dichlorobenzo[b]thiophen-2-yl)carboxamide
| Molecular Formula | C22H21Cl2N3O2S2 |
|---|---|
| Molecular Weight | 493.04523 g/mol |
| LogP | 5.5294 |
| Topological Polar Surface Area | 53.93 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 6 |
| Exact Mass | 493.04523 |
| Monoisotopic Mass | 493.04523 |
| Heavy Atoms | 31 |
| Complexity | 1127.3867 |
Chemical Identifiers
| CAS Number | 444930-75-0 |
|---|---|
| SMILES | COC1=C(C=C(C=C1)/C=N/NC(=O)C2=C(C3=C(S2)C=CC=C3Cl)Cl)CN4CCSCC4 |
Product Overview
AC1OB68D (CAS 444930-75-0), with molecular formula C22H21Cl2N3O2S2 and molecular weight 493.04523 g/mol. IUPAC: 3,4-dichloro-N-[(E)-[4-methoxy-3-(thiomorpholin-4-ylmethyl)phenyl]methylideneamino]-1-benzothiophene-2-carboxamide.
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