57370-13-5
2,6-BIS(2-HYDROXYETHYLAMINO)-4,8-DIPIPERIDINOPYRIMIDO(5,4-D)PYRIMIDINE
Name2,6-BIS(2-HYDROXYETHYLAMINO)-4,8-DIPIPERIDINOPYRIMIDO(5,4-D)PYRIMIDINE
1Identification
【Name】
2,6-BIS(2-HYDROXYETHYLAMINO)-4,8-DIPIPERIDINOPYRIMIDO(5,4-D)PYRIMIDINE
【CAS】
【MDL】
MFCD10566695
【English Synonyms】
【Formula】
C20 H32 N8 O2
【MolWeight】
416.527
【Inchi】
InChI=1S/C20H32N8O2/c29-13-7-21-19-24-16-15(17(25-19)27-9-3-1-4-10-27)23-20(22-8-14-30)26-18(16)28-11-5-2-6-12-28/h29-30H,1-14H2,(H,21,24,25)(H,22,23,26)
【InChIKey】
InChIKey=PNNHNKCEAAYNQD-UHFFFAOYSA-N
【SMILES】
C1CCN(CC1)c2c3c(c(nc(n3)NCCO)N4CCCCC4)nc(n2)NCCO
【MOL File】
2,6-BIS(2-HYDROXYETH….mol
2Chemical and Physical Properties
【Computed Properties】
H bond donor:4
H bond acceptor:10
XLogP3:3.0
Bulk/Fine:F
3Material Safety Data Sheet(MSDS)
4CML File
2,6-BIS(2-HYDROXYETHYLAMINO)-4,8-DIPIPERIDINOPYRIMIDO(5,4-D)PYRIMIDINE.cml