AC1NKYKR structure

AC1NKYKR

6-(3-chloro-2-methylphenyl)-4-methyl-2-(2-morpholin-4-ylethyl)-7,8-dihydropurino[7,8-a]imidazole-1,3-dione

Also Known As: 8-(3-chloro-2-methylphenyl)-1-methyl-3-(2-morpholinoethyl)-7,8-dihydro-1H-imidazo[2,1-f]purine-2,4(3H,6H)-dione|F1891-0441|6-(3-chloro-2-methylphenyl)-4-methyl-2-(2-morpholin-4-ylethyl)-7,8-dihydropurino[7,8-a]imidazole-1,3-dione|8-(3-chloro-2-methylphenyl)-1-methyl-3-(2-morpholin-4-ylethyl)-1,3,5-trihydroi midazolidino[1,2-h]purine-2,4-dione|8-(3-chloro-2-methylphenyl)-1-methyl-3-[2-(morpholin-4-yl)ethyl]-7,8-dihydro-1H-imidazo[2,1-f]purine-2,4(3H,6H)-dione

CAS: 893967-49-2
Molecular Formula C21H25ClN6O3
Molecular Weight 444.16766 g/mol
LogP 1.34242
Topological Polar Surface Area 77.53 Ų
Hydrogen Bond Donors 0
Hydrogen Bond Acceptors 6
Rotatable Bonds 4
Exact Mass 444.16766
Monoisotopic Mass 444.16766
Heavy Atoms 31
Complexity 1270.8264

Chemical Identifiers

CAS Number 893967-49-2
SMILES CC1=C(C=CC=C1Cl)N2CCN3C2=NC4=C3C(=O)N(C(=O)N4C)CCN5CCOCC5

Product Overview

AC1NKYKR (CAS 893967-49-2), with molecular formula C21H25ClN6O3 and molecular weight 444.16766 g/mol. IUPAC: 6-(3-chloro-2-methylphenyl)-4-methyl-2-(2-morpholin-4-ylethyl)-7,8-dihydropurino[7,8-a]imidazole-1,3-dione.

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