AC1MGI7Z

ethyl 4-[[1,3-dimethyl-2,6-dioxo-7-(2-phenylethyl)purin-8-yl]methyl]piperazine-1-carboxylate

Also Known As: ethyl 4-{[1,3-dimethyl-2,6-dioxo-7-(2-phenylethyl)-2,3,6,7-tetrahydro-1H-purin-8-yl]methyl}piperazine-1-carboxylate|Ethyl 4-[(1,3-dimethyl-2,6-dioxo-7-phenethyl-purin-8-yl)methyl]piperazine-1-carboxylate|ethyl 4-[(1,3-dimethyl-2,6-dioxo-7-phenethylpurin-8-yl)methyl]piperazine-1-carboxylate|ethyl 4-((1,3-dimethyl-2,6-dioxo-7-phenethyl-2,3,6,7-tetrahydro-1H-purin-8-yl)methyl)piperazine-1-carboxylate|ethyl 4-{[1,3-dimethyl-2,6-dioxo-7-(2-phenylethyl)-1,3,7-trihydropurin-8-yl]me thyl}piperazinecarboxylate

Molecular Formula	C23H30N6O4
Molecular Weight	454.23285 g/mol
LogP	0.9505
Topological Polar Surface Area	94.6 Ų
Hydrogen Bond Donors	0
Hydrogen Bond Acceptors	6
Rotatable Bonds	6
Exact Mass	454.23285
Monoisotopic Mass	454.23285
Heavy Atoms	33
Complexity	1251.9227

Chemical Identifiers

CAS Number	838875-49-3
SMILES	CCOC(=O)N1CCN(CC1)CC2=NC3=C(N2CCC4=CC=CC=C4)C(=O)N(C(=O)N3C)C