AC1NKDF7

methyl 2-[4,7-dimethyl-1,3-dioxo-6-(2-phenylethyl)purino[7,8-a]imidazol-2-yl]propanoate

Also Known As: methyl 2-[1,7-dimethyl-2,4-dioxo-8-(2-phenylethyl)-1,3,5-trihydro-4-imidazolin o[1,2-h]purin-3-yl]propanoate|methyl 2-(4,7-dimethyl-1,3-dioxo-6-phenethylpurino[7,8-a]imidazol-2-yl)propanoate|methyl 2-(1,7-dimethyl-2,4-dioxo-8-phenethyl-1H-imidazo[2,1-f]purin-3(2H,4H,8H)-yl)propanoate|methyl 2-[1,7-dimethyl-2,4-dioxo-8-(2-phenylethyl)-1,2,4,8-tetrahydro-3H-imidazo[2,1-f]purin-3-yl]propanoate

Molecular Formula	C21H23N5O4
Molecular Weight	409.17502 g/mol
LogP	1.43452
Topological Polar Surface Area	92.53 Ų
Hydrogen Bond Donors	0
Hydrogen Bond Acceptors	5
Rotatable Bonds	5
Exact Mass	409.17502
Monoisotopic Mass	409.17502
Heavy Atoms	30
Complexity	1374.1605

Chemical Identifiers

CAS Number	896597-31-2
SMILES	CC1=CN2C3=C(N=C2N1CCC4=CC=CC=C4)N(C(=O)N(C3=O)C(C)C(=O)OC)C