AC1M03XX structure

AC1M03XX

N-[5-cyano-2-oxo-7-(3-propan-2-yloxypropyl)-1,7,9-triazatricyclo[8.4.0.03,8]tetradeca-3(8),4,9,11,13-pentaen-6-ylidene]-3,4-dimethylbenzamide

Also Known As: (E)-N-(3-cyano-1-(3-isopropoxypropyl)-5-oxo-1H-dipyrido[1,2-a:2',3'-d]pyrimidin-2(5H)-ylidene)-3,4-dimethylbenzamide|N-{(2E)-3-cyano-5-oxo-1-[3-(propan-2-yloxy)propyl]-1,5-dihydro-2H-dipyrido[1,2-a:2',3'-d]pyrimidin-2-ylidene}-3,4-dimethylbenzamide

CAS: 845809-42-9
Molecular Formula C27H27N5O3
Molecular Weight 469.2114 g/mol
LogP 3.69392
Topological Polar Surface Area 101.75 Ų
Hydrogen Bond Donors 0
Hydrogen Bond Acceptors 5
Rotatable Bonds 6
Exact Mass 469.2114
Monoisotopic Mass 469.2114
Heavy Atoms 35
Complexity 1605.9899

Chemical Identifiers

CAS Number 845809-42-9
SMILES CC1=C(C=C(C=C1)C(=O)N=C2C(=CC3=C(N2CCCOC(C)C)N=C4C=CC=CN4C3=O)C#N)C

Product Overview

AC1M03XX (CAS 845809-42-9), with molecular formula C27H27N5O3 and molecular weight 469.2114 g/mol. IUPAC: N-[5-cyano-2-oxo-7-(3-propan-2-yloxypropyl)-1,7,9-triazatricyclo[8.4.0.03,8]tetradeca-3(8),4,9,11,13-pentaen-6-ylidene]-3,4-dimethylbenzamide.

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