AC1MHX5I structure

AC1MHX5I

1-[(3S,3aR)-8-methoxy-5-(4-methylphenyl)sulfonyl-3-phenyl-3a,4-dihydro-3H-pyrazolo[4,3-c]quinolin-2-yl]ethanone

Also Known As: 2H-Pyrazolo(4,3-c)quinoline, 3,3a,4,5-tetrahydro-2-acetyl-8-methoxy-5-((4-methylphenyl)sulfonyl)-3-phenyl-, cis-|1-[(3S,3aR)-8-Methoxy-5-(4-methylbenzene-1-sulfonyl)-3-phenyl-3,3a,4,5-tetrahydro-2H-pyrazolo[4,3-c]quinolin-2-yl]ethan-1-one|1-[(3S,3aR)-8-methoxy-5-(4-methylphenyl)sulfonyl-3-phenyl-3a,4-dihydro-3H-pyrazolo[4,3-c]quinolin-2-yl]ethanone

CAS: 76263-73-5
Molecular Formula C26H25N3O4S
Molecular Weight 475.1566 g/mol
LogP 4.13622
Topological Polar Surface Area 79.28 Ų
Hydrogen Bond Donors 0
Hydrogen Bond Acceptors 5
Rotatable Bonds 4
Exact Mass 475.1566
Monoisotopic Mass 475.1566
Heavy Atoms 34
Complexity 1385.303

Chemical Identifiers

CAS Number 76263-73-5
SMILES CC1=CC=C(C=C1)S(=O)(=O)N2C[C@@H]3[C@H](N(N=C3C4=C2C=CC(=C4)OC)C(=O)C)C5=CC=CC=C5

Product Overview

AC1MHX5I (CAS 76263-73-5), with molecular formula C26H25N3O4S and molecular weight 475.1566 g/mol. IUPAC: 1-[(3S,3aR)-8-methoxy-5-(4-methylphenyl)sulfonyl-3-phenyl-3a,4-dihydro-3H-pyrazolo[4,3-c]quinolin-2-yl]ethanone.

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