55921-70-5
4-CHLORO-2-(2-HYDROXYETHYLAMINO)-6-(4-METHYLPIPERAZINO)-5-(METHYLTHIO)PYRIMIDINE
Name4-CHLORO-2-(2-HYDROXYETHYLAMINO)-6-(4-METHYLPIPERAZINO)-5-(METHYLTHIO)PYRIMIDINE
1Identification
【Name】
4-CHLORO-2-(2-HYDROXYETHYLAMINO)-6-(4-METHYLPIPERAZINO)-5-(METHYLTHIO)PYRIMIDINE
【CAS】
【MDL】
MFCD01689700
【English Synonyms】
【Formula】
C12 H20 Cl N5 O S
【MolWeight】
317.843
【Inchi】
InChI=1S/C12H20ClN5OS/c1-17-4-6-18(7-5-17)11-9(20-2)10(13)15-12(16-11)14-3-8-19/h19H,3-8H2,1-2H3,(H,14,15,16)
【InChIKey】
InChIKey=RUDQYVYWAGQGNG-UHFFFAOYSA-N
【SMILES】
CN1CCN(CC1)c2c(c(nc(n2)NCCO)Cl)SC
【MOL File】
4-CHLORO-2-(2-HYDROX….mol
2Chemical and Physical Properties
【Computed Properties】
H bond donor:2
H bond acceptor:6
XLogP3:0.0
Bulk/Fine:F
3Material Safety Data Sheet(MSDS)
4CML File
4-CHLORO-2-(2-HYDROXYETHYLAMINO)-6-(4-METHYLPIPERAZINO)-5-(METHYLTHIO)PYRIMIDINE.cml