AC1MKSQJ structure

AC1MKSQJ

6-(4-ethoxyphenyl)-2-(3-hydroxypropyl)-4,7-dimethylpurino[7,8-a]imidazole-1,3-dione

Also Known As: BAS 12522819|UPCMLD0ENAT5793535:001|6-(4-ethoxyphenyl)-2-(3-hydroxypropyl)-4,7-dimethylpurino[7,8-a]imidazole-1,3-dione|8-(4-ethoxyphenyl)-3-(3-hydroxypropyl)-1,7-dimethyl-1,3,5-trihydro-4-imidazoli no[1,2-h]purine-2,4-dione

CAS: 876901-58-5
Molecular Formula C20H23N5O4
Molecular Weight 397.17502 g/mol
LogP 1.22812
Topological Polar Surface Area 95.69 Ų
Hydrogen Bond Donors 1
Hydrogen Bond Acceptors 5
Rotatable Bonds 6
Exact Mass 397.17502
Monoisotopic Mass 397.17502
Heavy Atoms 29
Complexity 1307.6256

Chemical Identifiers

CAS Number 876901-58-5
SMILES CCOC1=CC=C(C=C1)N2C(=CN3C2=NC4=C3C(=O)N(C(=O)N4C)CCCO)C

Product Overview

AC1MKSQJ (CAS 876901-58-5), with molecular formula C20H23N5O4 and molecular weight 397.17502 g/mol. IUPAC: 6-(4-ethoxyphenyl)-2-(3-hydroxypropyl)-4,7-dimethylpurino[7,8-a]imidazole-1,3-dione.

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