AC1NTNBW structure

AC1NTNBW

2-[2-[3-[[4-(2-hydroxyphenyl)-6-phenylpyrimidin-2-yl]amino]propylamino]-6-phenylpyrimidin-4-yl]phenol

Also Known As: (6E)-6-[2-[3-[[(6E)-6-(6-oxocyclohexa-2,4-dien-1-ylidene)-4-|(6E)-6-[2-[3-[[(6E)-6-(6-oxocyclohexa-2,4-dien-1-ylidene)-4-phenyl-1H-pyrimidin-2-yl]amino]propylamino]-4-phenyl-1H-pyrimidin-6-ylidene]cyclohexa-2,4-dien-1-one|(6E,6'E)-6,6'-{Propane-1,3-diylbis[azanediyl(6-phenylpyrimidin-2-yl-4-ylidene)]}di(cyclohexa-2,4-dien-1-one)|(6Z)-6-[2-[3-[[(6E)-6-(6-oxocyclohexa-2,4-dien-1-ylidene)-4-phenyl-1H-pyrimidin-2-yl]amino]propylamino]-4-phenyl-1H-pyrimidin-6-ylidene]cyclohexa-2,4-dien-1-one|2-[2-[3-[[4-(2-Hydroxyphenyl)-6-phenylpyrimidin-2-yl]amino]propylamino]-6-phenylpyrimidin-4-yl]phenol|6-[2-[3-[[6-(6-oxocyclohexa-2,4-dien-1-ylidene)-4-phenyl-1H-pyrimidin-2-yl]amino]propylamino]-4-phenyl-1H-pyrimidin-6-ylidene]cyclohexa-2,4-dien-1-one

CAS: 92736-17-9
Molecular Formula C35H30N6O2
Molecular Weight 566.24304 g/mol
LogP 7.1
Topological Polar Surface Area 116.0 Ų
Hydrogen Bond Donors 4
Hydrogen Bond Acceptors 8
Rotatable Bonds 10
Exact Mass 566.24304
Monoisotopic Mass 566.24304
Heavy Atoms 43
Complexity 743.0

Chemical Identifiers

CAS Number 92736-17-9
SMILES C1=CC=C(C=C1)C2=CC(=NC(=N2)NCCCNC3=NC(=CC(=N3)C4=CC=CC=C4O)C5=CC=CC=C5)C6=CC=CC=C6O
InChIKey ZJRJQERZZYZPMO-UHFFFAOYSA-N

Product Overview

AC1NTNBW (CAS 92736-17-9), with molecular formula C35H30N6O2 and molecular weight 566.24304 g/mol. IUPAC: 2-[2-[3-[[4-(2-hydroxyphenyl)-6-phenylpyrimidin-2-yl]amino]propylamino]-6-phenylpyrimidin-4-yl]phenol.

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Safety Data Sheet (MSDS / SDS) View the Laboratory Chemical Safety Summary (LCSS) on PubChem — includes GHS classifications, hazard statements, first aid measures, and handling precautions.
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