2H-苯并咪唑-2-硫酮,5-氟-1,3-二氢-6-甲氧基-(9CI)

141363-92-0

MFCD00909869

C23 H37 N O9

471.543

InChI=1S/C23H37NO9/c1-5-6-7-8-9-13(2)21-22(20(30-4)14(3)12-31-21)33-16(26)10-24-23-19(29)18(28)17(27)15(11-25)32-23/h5-9,14-15,17-25,27-29H,10-12H2,1-4H3/b6-5+,8-7+,13-9+/t14-,15+,17+,18-,19+,20-,21-,22+,23+/m0/s1

InChIKey=OYYWJRVVYVMXBN-CGDKZCTRSA-N

C/C=C/C=C/C=C(\C)/[C@H]1[C@@H]([C@H]([C@H](CO1)C)OC)OC(=O)CN[C@H]2[C@@H]([C@H]([C@@H]([C@H](O2)CO)O)O)O

pro_donors:5

pro_acceptors:10

XLogP3:1.0

Bulk/Fine:F