AC1NF2IJ structure

AC1NF2IJ

N-(4-butylphenyl)-2-[(4-oxo-3-phenyl-5H-pyrimido[5,4-b]indol-2-yl)sulfanyl]acetamide

Also Known As: Oprea1_694441|AB00668810-01|F0580-0139|N-(4-butylphenyl)-2-((4-oxo-3-phenyl-4,5-dihydro-3H-pyrimido[5,4-b]indol-2-yl)thio)acetamide|N-(4-butylphenyl)-2-({4-oxo-3-phenyl-3H,4H,5H-pyrimido[5,4-b]indol-2-yl}sulfanyl)acetamide|N-(4-butylphenyl)-2-[(4-oxo-3-phenyl-5H-pyrimido[5,4-b]indol-2-yl)sulfanyl]acetamide

CAS: 536703-85-2
Molecular Formula C28H26N4O2S
Molecular Weight 482.17764 g/mol
LogP 5.9404
Topological Polar Surface Area 79.78 Ų
Hydrogen Bond Donors 2
Hydrogen Bond Acceptors 4
Rotatable Bonds 8
Exact Mass 482.17764
Monoisotopic Mass 482.17764
Heavy Atoms 35
Complexity 1539.1445

Chemical Identifiers

CAS Number 536703-85-2
SMILES CCCCC1=CC=C(C=C1)NC(=O)CSC2=NC3=C(C(=O)N2C4=CC=CC=C4)NC5=CC=CC=C53

Product Overview

AC1NF2IJ (CAS 536703-85-2), with molecular formula C28H26N4O2S and molecular weight 482.17764 g/mol. IUPAC: N-(4-butylphenyl)-2-[(4-oxo-3-phenyl-5H-pyrimido[5,4-b]indol-2-yl)sulfanyl]acetamide.

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