AC1MKR8V structure

AC1MKR8V

8-chloro-7-[2-hydroxy-3-(3-methylphenoxy)propyl]-1,3-dimethylpurine-2,6-dione

Also Known As: BAS 12400971|8-chloro-7-(2-hydroxy-3-(m-tolyloxy)propyl)-1,3-dimethyl-1H-purine-2,6(3H,7H)-dione|8-chloro-7-[2-hydroxy-3-(3-methylphenoxy)propyl]-1,3-dimethylpurine-2,6-dione|8-chloro-7-[2-hydroxy-3-(3-methylphenoxy)propyl]-1,3-dimethyl-3,7-dihydro-1H-purine-2,6-dione

CAS: 32319-95-2
Molecular Formula C17H19ClN4O4
Molecular Weight 378.1095 g/mol
LogP 0.83542
Topological Polar Surface Area 91.28 Ų
Hydrogen Bond Donors 1
Hydrogen Bond Acceptors 5
Rotatable Bonds 5
Exact Mass 378.1095
Monoisotopic Mass 378.1095
Heavy Atoms 26
Complexity 1082.782

Chemical Identifiers

CAS Number 32319-95-2
SMILES CC1=CC(=CC=C1)OCC(CN2C3=C(N=C2Cl)N(C(=O)N(C3=O)C)C)O

Product Overview

AC1MKR8V (CAS 32319-95-2), with molecular formula C17H19ClN4O4 and molecular weight 378.1095 g/mol. IUPAC: 8-chloro-7-[2-hydroxy-3-(3-methylphenoxy)propyl]-1,3-dimethylpurine-2,6-dione.

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