AC1NL8RE

6-(2-chlorophenyl)-4,7,8-trimethyl-2-(2-methylprop-2-enyl)purino[7,8-a]imidazole-1,3-dione

Also Known As: BAS 12662897|UPCMLD0ENAT5815615:001|6-(2-chlorophenyl)-4,7,8-trimethyl-2-(2-methylprop-2-enyl)purino[7,8-a]imidazole-1,3-dione|8-(2-chlorophenyl)-1,6,7-trimethyl-3-(2-methylprop-2-en-1-yl)-1H-imidazo[2,1-f]purine-2,4(3H,8H)-dione|8-(2-chlorophenyl)-1,6,7-trimethyl-3-(2-methylprop-2-en-1-yl)-1H,2H,3H,4H,8H-imidazo[1,2-g]purine-2,4-dione|8-(2-chlorophenyl)-1,6,7-trimethyl-3-(2-methylallyl)-1H-imidazo[2,1-f]purine-2,4(3H,8H)-dione|8-(2-chlorophenyl)-1,6,7-trimethyl-3-(2-methylprop-2-enyl)-1,3,5-trihydro-4-im idazolino[1,2-h]purine-2,4-dione

Molecular Formula	C20H20ClN5O2
Molecular Weight	397.13055 g/mol
LogP	2.98494
Topological Polar Surface Area	66.23 Ų
Hydrogen Bond Donors	0
Hydrogen Bond Acceptors	3
Rotatable Bonds	3
Exact Mass	397.13055
Monoisotopic Mass	397.13055
Heavy Atoms	28
Complexity	1400.4818

Chemical Identifiers

CAS Number	876672-72-9
SMILES	CC1=C(N2C3=C(N=C2N1C4=CC=CC=C4Cl)N(C(=O)N(C3=O)CC(=C)C)C)C