AC1NIODQ

methyl 2-[9-[2-(3,4-dimethoxyphenyl)ethyl]-1-methyl-2,4-dioxo-7,8-dihydro-6H-purino[7,8-a]pyrimidin-3-yl]acetate

Also Known As: methyl 2-[9-[2-(3,4-dimethoxyphenyl)ethyl]-1-methyl-2,4-dioxo-7,8-dihydro-6H-purino[7,8-a]pyrimidin-3-yl]acetate|methyl {9-[2-(3,4-dimethoxyphenyl)ethyl]-1-methyl-2,4-dioxo-1,4,6,7,8,9-hexahydropyrimido[2,1-f]purin-3(2H)-yl}acetate|methyl 2-(9-(3,4-dimethoxyphenethyl)-1-methyl-2,4-dioxo-1,2,6,7,8,9-hexahydropyrimido[2,1-f]purin-3(4H)-yl)acetate|methyl 2-{9-[2-(3,4-dimethoxyphenyl)ethyl]-1-methyl-2,4-dioxo-1,3,5-trihydro-6 H,7H,8H-1,3-diazaperhydroino[1,2-h]purin-3-yl}acetate|methyl 2-{9-[2-(3,4-dimethoxyphenyl)ethyl]-1-methyl-2,4-dioxo-1H,2H,3H,4H,6H,7H,8H,9H-pyrimido[1,2-g]purin-3-yl}acetate

Molecular Formula	C22H27N5O6
Molecular Weight	457.19614 g/mol
LogP	0.5397
Topological Polar Surface Area	109.82 Ų
Hydrogen Bond Donors	0
Hydrogen Bond Acceptors	8
Rotatable Bonds	7
Exact Mass	457.19614
Monoisotopic Mass	457.19614
Heavy Atoms	33
Complexity	1321.5283

Chemical Identifiers

CAS Number	893958-91-3
SMILES	CN1C2=C(C(=O)N(C1=O)CC(=O)OC)N3CCCN(C3=N2)CCC4=CC(=C(C=C4)OC)OC