AC1N3EP1
N-(6-chloro-3-methyl-1,3-benzothiazol-2-ylidene)-4-(3,4-dihydro-1H-isoquinolin-2-ylsulfonyl)benzamide
Also Known As: Oprea1_298359|F0473-0290|(Z)-N-(6-chloro-3-methylbenzo[d]thiazol-2(3H)-ylidene)-4-((3,4-dihydroisoquinolin-2(1H)-yl)sulfonyl)benzamide|N-[(2Z)-6-chloro-3-methyl-2,3-dihydro-1,3-benzothiazol-2-ylidene]-4-(1,2,3,4-tetrahydroisoquinoline-2-sulfonyl)benzamide|N-(6-chloro-3-methyl-1,3-benzothiazol-2-ylidene)-4-(3,4-dihydro-1H-isoquinolin-2-ylsulfonyl)benzamide|N-(6-chloro-3-methyl-benzothiazol-2-ylidene)-4-(3,4-dihydro-1H-isoquinolin-2-ylsulfonyl)benzamide
| Molecular Formula | C24H20ClN3O3S2 |
|---|---|
| Molecular Weight | 497.06348 g/mol |
| LogP | 4.3813 |
| Topological Polar Surface Area | 71.74 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 497.06348 |
| Monoisotopic Mass | 497.06348 |
| Heavy Atoms | 33 |
| Complexity | 1554.125 |
Chemical Identifiers
| CAS Number | 391876-64-5 |
|---|---|
| SMILES | CN1C2=C(C=C(C=C2)Cl)SC1=NC(=O)C3=CC=C(C=C3)S(=O)(=O)N4CCC5=CC=CC=C5C4 |
Product Overview
AC1N3EP1 (CAS 391876-64-5), with molecular formula C24H20ClN3O3S2 and molecular weight 497.06348 g/mol. IUPAC: N-(6-chloro-3-methyl-1,3-benzothiazol-2-ylidene)-4-(3,4-dihydro-1H-isoquinolin-2-ylsulfonyl)benzamide.
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