Vitas-M small molecule compound

4-(3,4-difluorophenyl)-5-nitro-1-(propan-2-yl)-4,7-dihydro-1H-pyrazolo[3,4-b]pyridine-3,6(2H,5H)-dione

Catalog ID
STL434426
SMILES [O-][N+](=O)C1C(=O)Nc2c(C1c1ccc(c(c1)F)F)c(=O)[nH]n2C(C)C

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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 C15H14F2N4O4 MW 352.30 g/mol Purity >90% as per NMR
InChI
InChI=1S/C15H14F2N4O4/c1-6(2)20-13-11(14(22)19-20)10(12(21(24)25)15(23)18-13)7-3-4-8(16)9(17)5-7/h3-6,10,12H,1-2H3,(H,18,23)(H,19,22)
InChIKey
PUAUWCDEPDBEKL-UHFFFAOYSA-N
Synonyms

(O)(N+)(=O)C1C(=O)Nc2c(C1c1ccc(c(c1)F)F)c(=O)(nH)n2C(C)C
4(34difluorophenyl)5nitro1(propan2yl)47dihydro1Hpyrazolo(34b)pyridine36(2H5H)dione
4(34difluorophenyl)5nitro1propan2yl2457tetrahydropyrazolo(34b)pyridine36dione
CC(C)N1C2=C(C(C(C(=O)N2)(N+)(=O)(O))C3=CC(=C(C=C3)F)F)C(=O)N1
InChI=1SC15H14F2N4O4c16(2)201311(14(22)1920)10(12(21(24)25)15(23)1813)7348(16)9(17)57h361012H12H3(H1823)(H1922)
MFCD26098833
ZINC000100255139
ZINC000100255150

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Available files

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