AC1LQ7VZ

7-[(3-fluorophenyl)methyl]-8-[(2-fluorophenyl)methylsulfanyl]-1,3-dimethylpurine-2,6-dione

Also Known As: 7-[(3-fluorophenyl)methyl]-8-[(2-fluorophenyl)methylsulfanyl]-1,3-dimethylpurine-2,6-dione|7-(3-fluorobenzyl)-8-((2-fluorobenzyl)thio)-1,3-dimethyl-1H-purine-2,6(3H,7H)-dione|7-(3-fluorobenzyl)-8-[(2-fluorobenzyl)sulfanyl]-1,3-dimethyl-3,7-dihydro-1H-purine-2,6-dione|7-[(3-fluorophenyl)methyl]-8-[(2-fluorophenyl)methylsulfanyl]-1,3-dimethyl-purine-2,6-dione

Molecular Formula	C21H18F2N4O2S
Molecular Weight	428.11185 g/mol
LogP	3.0525
Topological Polar Surface Area	61.82 Ų
Hydrogen Bond Donors	0
Hydrogen Bond Acceptors	4
Rotatable Bonds	5
Exact Mass	428.11185
Monoisotopic Mass	428.11185
Heavy Atoms	30
Complexity	1373.9271

Chemical Identifiers

CAS Number	812641-63-7
SMILES	CN1C2=C(C(=O)N(C1=O)C)N(C(=N2)SCC3=CC=CC=C3F)CC4=CC(=CC=C4)F