Vitas-M small molecule compound

5-(1,3-benzodioxol-5-ylmethyl)-4-methyl-2-phenyl-1H-pyrazolo[4,3-c]pyridine-3,6(2H,5H)-dione

Catalog ID
STK261821
SMILES O=c1cc2[nH]n(c(=O)c2c(n1Cc1ccc2c(c1)OCO2)C)c1ccccc1

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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 C21H17N3O4 MW 375.38 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H17N3O4/c1-13-20-16(22-24(21(20)26)15-5-3-2-4-6-15)10-19(25)23(13)11-14-7-8-17-18(9-14)28-12-27-17/h2-10,22H,11-12H2,1H3
InChIKey
ANUFFQUQIIVNIW-UHFFFAOYSA-N
Synonyms

5(13benzodioxol5ylmethyl)4methyl2phenyl1Hpyrazolo(43c)pyridine36(2H5H)dione
5(13BENZODIOXOL5YLMETHYL)4METHYL2PHENYL1HPYRAZOLO(43C)PYRIDINE36DIONE
5(2HBENZO(34D)13DIOXOLAN5YLMETHYL)4METHYL2PHENYL5HYDRO3PYRAZOLINO(43C)PYRIDINE36DIONE
5(BENZO(D)(13)DIOXOL5YLMETHYL)4METHYL2PHENYL1HPYRAZOLO(43C)PYRIDINE36(2H5H)DIONE
CC1=C2C(=CC(=O)N1CC3=CC4=C(C=C3)OCO4)NN(C2=O)C5=CC=CC=C5
InChI=1SC21H17N3O4c1132016(2224(21(20)26)155324615)1019(25)23(13)1114781718(914)28122717h21022H1112H21H3
MFCD06754459
O=c1cc2(nH)n(c(=O)c2c(n1Cc1ccc2c(c1)OCO2)C)c1ccccc1
ZINC000005274875
ZINC05274875
ZINC5274875

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Available files

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