TOXURAZINE

88823-01-2

MFCD15146919

C8 H14 Cl N5 . C8 H7 Cl3 O2 . C2 H4 N4

541.268

InChI=1S/C8H7Cl3O2.C8H14ClN5.C2H4N4/c9-5-3-7(11)8(4-6(5)10)13-2-1-12;1-4-10-7-12-6(9)13-8(14-7)11-5(2)3;3-2-4-1-5-6-2/h3-4,12H,1-2H2;5H,4H2,1-3H3,(H2,10,11,12,13,14);1H,(H3,3,4,5,6)

InChIKey=UJWDBLRCAHQPMS-UHFFFAOYSA-N

CCNc1nc(nc(n1)Cl)NC(C)C.c1c(c(cc(c1Cl)Cl)Cl)OCCO.c1[nH]nc(n1)N

pro_donors:1

pro_acceptors:2

XLogP3:2.0

Bulk/Fine:F