AC1NKY00 structure

AC1NKY00

1-[4-[(4-methoxyphenoxy)methyl]-11-methyl-13-phenyl-10-oxa-3,5,6,8-tetrazatricyclo[7.4.0.02,6]trideca-1(9),2,4,7,11-pentaen-12-yl]ethanone

Also Known As: 1-(2-((4-methoxyphenoxy)methyl)-8-methyl-10-phenyl-10H-pyrano[3,2-e][1,2,4]triazolo[1,5-c]pyrimidin-9-yl)ethanone|1-{2-[(4-methoxyphenoxy)methyl]-8-methyl-10-phenyl-10H-pyrano[3,2-e][1,2,4]triazolo[1,5-c]pyrimidin-9-yl}ethanone

CAS: 902011-93-2
Molecular Formula C25H22N4O4
Molecular Weight 442.1641 g/mol
LogP 4.0992
Topological Polar Surface Area 87.84 Ų
Hydrogen Bond Donors 0
Hydrogen Bond Acceptors 7
Rotatable Bonds 6
Exact Mass 442.1641
Monoisotopic Mass 442.1641
Heavy Atoms 33
Complexity 1360.6982

Chemical Identifiers

CAS Number 902011-93-2
SMILES CC1=C(C(C2=C(O1)N=CN3C2=NC(=N3)COC4=CC=C(C=C4)OC)C5=CC=CC=C5)C(=O)C

Product Overview

AC1NKY00 (CAS 902011-93-2), with molecular formula C25H22N4O4 and molecular weight 442.1641 g/mol. IUPAC: 1-[4-[(4-methoxyphenoxy)methyl]-11-methyl-13-phenyl-10-oxa-3,5,6,8-tetrazatricyclo[7.4.0.02,6]trideca-1(9),2,4,7,11-pentaen-12-yl]ethanone.

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