MLS000527309

7-[2-[4-(2,3-dimethylphenyl)piperazin-1-yl]-2-oxoethyl]-1,3-dimethylpurine-2,6-dione

Also Known As: Oprea1_628664|BAS 03033741|7-{2-[4-(2,3-dimethylphenyl)piperazin-1-yl]-2-oxoethyl}-1,3-dimethyl-3,7-dihydro-1H-purine-2,6-dione|7-[2-[4-(2,3-dimethylphenyl)piperazin-1-yl]-2-oxoethyl]-1,3-dimethylpurine-2,6-dione|7-(2-(4-(2,3-dimethylphenyl)piperazin-1-yl)-2-oxoethyl)-1,3-dimethyl-1H-purine-2,6(3H,7H)-dione|7-{2-[4-(2,3-Dimethyl-phenyl)-piperazin-1-yl]-2-oxo-ethyl}-1,3-dimethyl-3,7-dihydro-purine-2,6-dione|7-{2-[4-(2,3-dimethylphenyl)piperazin-1-yl]-2-oxoethyl}-1,3-dimethyl-2,3,6,7-tetrahydro-1H-purine-2,6-dione|7-{2-[4-(2,3-DIMETHYLPHENYL)PIPERAZIN-1-YL]-2-OXOETHYL}-1,3-DIMETHYLPURINE-2,6-DIONE

Molecular Formula	C21H26N6O3
Molecular Weight	410.20663 g/mol
LogP	0.39934
Topological Polar Surface Area	85.37 Ų
Hydrogen Bond Donors	0
Hydrogen Bond Acceptors	5
Rotatable Bonds	3
Exact Mass	410.20663
Monoisotopic Mass	410.20663
Heavy Atoms	30
Complexity	1244.0858

Chemical Identifiers

CAS Number	349441-41-4
SMILES	CC1=C(C(=CC=C1)N2CCN(CC2)C(=O)CN3C=NC4=C3C(=O)N(C(=O)N4C)C)C