4-氨基-N-(3-甲氧基吡嗪-2-基)苯磺酰胺 - 5-(3,4,5-三甲氧苄基)嘧啶-2,4-二胺 (1:1)

50933-06-7

MFCD01657690

C14 H18 N4 O3 . C11 H12 N4 O3 S

570.628

InChI=1S/C14H18N4O3.C11H12N4O3S/c1-19-10-5-8(6-11(20-2)12(10)21-3)4-9-7-17-14(16)18-13(9)15;1-18-11-10(13-6-7-14-11)15-19(16,17)9-4-2-8(12)3-5-9/h5-7H,4H2,1-3H3,(H4,15,16,17,18);2-7H,12H2,1H3,(H,13,15)

InChIKey=DMIUGJLERMOBNT-UHFFFAOYSA-N

COc1cc(cc(c1OC)OC)Cc2cnc(nc2N)N.COc1c(nccn1)NS(=O)(=O)c2ccc(cc2)N

pro_donors:2

pro_acceptors:7

XLogP3:0.0

Bulk/Fine:F