AC1LD8OA

8-[2-(diethylamino)ethylamino]-3-methyl-7-(2-phenoxyethyl)purine-2,6-dione

Also Known As: BAS 04358692|NCGC00020185-01|NCGC00020185-02|SR-01000002077-2|F1144-0062|8-((2-(diethylamino)ethyl)amino)-3-methyl-7-(2-phenoxyethyl)-1H-purine-2,6(3H,7H)-dione|8-{[2-(diethylamino)ethyl]amino}-3-methyl-7-(2-phenoxyethyl)-2,3,6,7-tetrahydro-1H-purine-2,6-dione|8-(2-diethylaminoethylamino)-3-methyl-7-(2-phenoxyethyl)purine-2,6-dione|8((2-(DIETHYLAMINO)ET)AMINO)3-ME-7-(2-PHENOXY-ET)3,7-DIHYDRO-1H-PURINE-2,6-DIONE|8-[2-(diethylamino)ethylamino]-3-methyl-7-(2-phenoxyethyl)purine-2,6-dione|8-{[2-(diethylamino)ethyl]amino}-3-methyl-7-(2-phenoxyethyl)-1,3,7-trihydropur ine-2,6-dione|8-{[2-(diethylamino)ethyl]amino}-6-hydroxy-3-methyl-7-(2-phenoxyethyl)-3,7-dihydro-2H-purin-2-one

Molecular Formula	C20H28N6O3
Molecular Weight	400.2223 g/mol
LogP	2.1
Topological Polar Surface Area	91.7 Ų
Hydrogen Bond Donors	2
Hydrogen Bond Acceptors	6
Rotatable Bonds	10
Exact Mass	400.2223
Monoisotopic Mass	400.2223
Heavy Atoms	29
Complexity	552.0

Chemical Identifiers

CAS Number	536718-76-0
SMILES	CCN(CC)CCNC1=NC2=C(N1CCOC3=CC=CC=C3)C(=O)NC(=O)N2C
InChIKey	GDNNXPDCFZRUHO-UHFFFAOYSA-N