Vitas-M small molecule compound
3,3'-[(1-methyl-1H-pyrazol-5-yl)methanediyl]bis[7-(difluoromethyl)-4-hydroxy-9-methylthieno[2,3-b:4,5-b']dipyridin-2(1H)-one]
Catalog ID
STK305440
SMILES Cn1nccc1C(c1c(=O)[nH]c2c(c1O)sc1c2c(C)cc(n1)C(F)F)c1c(=O)[nH]c2c(c1O)sc1c2c(C)cc(n1)C(F)F
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We supply compounds in quantities from 1 mg up to 5 g for research and development purposes only.
We do not supply quantities above 5 g.
Structure and other identifiers
2D representation rendered from the SMILES, with core physicochemical data.Formula C29H20F4N6O4S2 MW 656.64 g/mol Purity >90% as per NMR
InChI
InChI=1S/C29H20F4N6O4S2/c1-8-6-10(24(30)31)35-28-13(8)18-22(44-28)20(40)16(26(42)37-18)15(12-4-5-34-39(12)3)17-21(41)23-19(38-27(17)43)14-9(2)7-11(25(32)33)36-29(14)45-23/h4-7,15,24-25H,1-3H3,(H2,37,40,42)(H2,38,41,43)InChIKey
KMEJJSOZPWUVEJ-UHFFFAOYSA-NSynonyms
1005662-69-01005662690
33((1methyl1Hpyrazol5yl)methanediyl)bis(7(difluoromethyl)4hydroxy9methylthieno(23b45b)dipyridin2(1H)one)
CC1=CC(=NC2=C1C3=C(S2)C(=C(C(=O)N3)C(C4=CC=NN4C)C5=C(C6=C(C7=C(S6)N=C(C=C7C)C(F)F)NC5=O)O)O)C(F)F
Cn1nccc1C(c1c(=O)(nH)c2c(c1O)sc1c2c(C)cc(n1)C(F)F)c1c(=O)(nH)c2c(c1O)sc1c2c(C)cc(n1)C(F)F
InChI=1SC29H20F4N6O4S2c18610(24(30)31)352813(8)1822(4428)20(40)16(26(42)3718)15(12453439(12)3)1721(41)2319(3827(17)43)149(2)711(25(32)33)3629(14)4523h47152425H13H3(H2374042)(H2384143)
MFCD04050685
ZINC000097949175
ZINC97949175
Check stock
See real-time availability and sample size for STK305440 on the Vitas-M platform.
Check stock on Vitas-MAvailable files
Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.