铬酸酯(1-), 二[3-[(4,5-二氢-3-甲基- 5-羰基-1-苯基-1H-吡唑-4-基)偶氮]-4-羟基 -N-苯基苯磺酰氨酸根(2-)]-,钠

141804-42-4

MFCD00910619

C35 H43 N5 O7 S

677.819

InChI=1S/C35H43N5O7S/c1-34(2,3)39-31(44)29-35(4,5)48-20-40(29)32(45)28(42)24(18-21-12-7-6-8-13-21)37-30(43)25(19-27(36)41)38-33(46)47-26-17-11-15-22-14-9-10-16-23(22)26/h6-17,24-25,28-29,42H,18-20H2,1-5H3,(H2,36,41)(H,37,43)(H,38,46)(H,39,44)/t24-,25-,28+,29+/m0/s1

InChIKey=ASLOLVRYTAOLQB-LYWOHPCHSA-N

CC1([C@H](N(CS1)C(=O)[C@@H]([C@H](Cc2ccccc2)NC(=O)[C@H](CC(=O)N)NC(=O)Oc3cccc4c3cccc4)O)C(=O)NC(C)(C)C)C

pro_donors:5

pro_acceptors:12

XLogP3:0.0

Bulk/Fine:F