Vitas-M small molecule compound

6-{(2E)-2-[3,4-bis(1,1,2,3,3,3-hexafluoropropoxy)benzylidene]hydrazinyl}-9H-purine

Catalog ID
STK944658
SMILES FC(C(Oc1cc(/C=N/Nc2ncnc3c2nc[nH]3)ccc1OC(C(C(F)(F)F)F)(F)F)(F)F)C(F)(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 C18H10F12N6O2 MW 570.30 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H10F12N6O2/c19-13(15(21,22)23)17(27,28)37-8-2-1-7(3-9(8)38-18(29,30)14(20)16(24,25)26)4-35-36-12-10-11(32-5-31-10)33-6-34-12/h1-6,13-14H,(H2,31,32,33,34,36)/b35-4+
InChIKey
LZDKHMCNTBMNCF-JYQPGJQPSA-N
Synonyms

6((2E)2(34bis(112333hexafluoropropoxy)benzylidene)hydrazinyl)9Hpurine
C1=CC(=C(C=C1C=NNC2=NC=NC3=C2NC=N3)OC(C(C(F)(F)F)F)(F)F)OC(C(C(F)(F)F)F)(F)F
FC(C(Oc1cc(C=NNc2ncnc3c2nc(nH)3)ccc1OC(C(C(F)(F)F)F)(F)F)(F)F)C(F)(F)F
InChI=1SC18H10F12N6O2c1913(15(2122)23)17(2728)378217(39(8)3818(2930)14(20)16(2425)26)43536121011(3253110)3363412h161314H(H23132333436)b354+
MFCD18180500
N((E)(34bis(112333hexafluoropropoxy)phenyl)methylideneamino)7Hpurin6amine
ZINC000097965326
ZINC000097965329

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.