AC1NA5NC

8-(4-ethylpiperazin-1-yl)-7-(2-hydroxy-3-phenoxypropyl)-3-methylpurine-2,6-dione

Also Known As: NCGC00316389-01|AB01312506-01|8-(4-ethylpiperazin-1-yl)-7-(2-hydroxy-3-phenoxypropyl)-3-methyl-1H-purine-2,6(3H,7H)-dione|F1687-0003|8-(4-ethylpiperazin-1-yl)-7-(2-hydroxy-3-phenoxypropyl)-3-methylpurine-2,6-dione|8-(4-ethylpiperazin-1-yl)-7-(2-hydroxy-3-phenoxypropyl)-3-methyl-2,3,6,7-tetrahydro-1H-purine-2,6-dione|8-(4-ethylpiperazin-1-yl)-7-(2-hydroxy-3-phenoxy-propyl)-3-methyl-purine-2,6-dione|8-(4-ethylpiperazin-1-yl)-6-hydroxy-7-(2-hydroxy-3-phenoxypropyl)-3-methyl-3,7-dihydro-2H-purin-2-one|8-(4-ethylpiperazin-1-yl)-7-(2-hydroxy-3-phenoxypropyl)-3-methyl-3,7-dihydro-1H-purine-2,6-dione

Molecular Formula	C21H28N6O4
Molecular Weight	428.2172 g/mol
LogP	0.0051
Topological Polar Surface Area	108.62 Ų
Hydrogen Bond Donors	2
Hydrogen Bond Acceptors	7
Rotatable Bonds	7
Exact Mass	428.2172
Monoisotopic Mass	428.2172
Heavy Atoms	31
Complexity	1144.3717

Chemical Identifiers

CAS Number	850237-29-5
SMILES	CCN1CCN(CC1)C2=NC3=C(N2CC(COC4=CC=CC=C4)O)C(=O)NC(=O)N3C