AC1NK9NF structure

AC1NK9NF

furan-2-yl-[4-[7-(2-methylpropyl)-10-thia-8,13,15-triazatetracyclo[7.7.0.02,6.011,16]hexadeca-1(9),2(6),7,11(16),12,14-hexaen-12-yl]piperazin-1-yl]methanone

Also Known As: Oprea1_383888|furan-2-yl(4-(4-isobutyl-2,3-dihydro-1H-cyclopenta[4',5']pyrido[3',2':4,5]thieno[3,2-d]pyrimidin-7-yl)piperazin-1-yl)methanone|furan-2-yl{4-[4-(2-methylpropyl)-2,3-dihydro-1H-cyclopenta[4',5']pyrido[3',2':4,5]thieno[3,2-d]pyrimidin-7-yl]piperazin-1-yl}methanone

CAS: 889793-24-2
Molecular Formula C25H27N5O2S
Molecular Weight 461.18854 g/mol
LogP 4.4821
Topological Polar Surface Area 75.36 Ų
Hydrogen Bond Donors 0
Hydrogen Bond Acceptors 7
Rotatable Bonds 4
Exact Mass 461.18854
Monoisotopic Mass 461.18854
Heavy Atoms 33
Complexity 1336.3481

Chemical Identifiers

CAS Number 889793-24-2
SMILES CC(C)CC1=NC2=C(C3=C1CCC3)C4=C(S2)C(=NC=N4)N5CCN(CC5)C(=O)C6=CC=CO6

Product Overview

AC1NK9NF (CAS 889793-24-2), with molecular formula C25H27N5O2S and molecular weight 461.18854 g/mol. IUPAC: furan-2-yl-[4-[7-(2-methylpropyl)-10-thia-8,13,15-triazatetracyclo[7.7.0.02,6.011,16]hexadeca-1(9),2(6),7,11(16),12,14-hexaen-12-yl]piperazin-1-yl]methanone.

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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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