Vitas-M small molecule compound

3-phenyl-4-(3,4,5-trimethoxyphenyl)-1,4,5,7-tetrahydro-6H-pyrazolo[3,4-b]pyridin-6-one

Catalog ID
STK780901
SMILES COc1cc(cc(c1OC)OC)C1CC(=O)Nc2c1c(n[nH]2)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 C21H21N3O4 MW 379.42 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H21N3O4/c1-26-15-9-13(10-16(27-2)20(15)28-3)14-11-17(25)22-21-18(14)19(23-24-21)12-7-5-4-6-8-12/h4-10,14H,11H2,1-3H3,(H2,22,23,24,25)
InChIKey
BAQOSBWWLPTPGL-UHFFFAOYSA-N
Synonyms
727683-30-9
3phenyl4(345trimethoxyphenyl)1245tetrahydropyrazolo(34b)pyridin6one
3phenyl4(345trimethoxyphenyl)1457tetrahydro6Hpyrazolo(34b)pyridin6one
3phenyl4(345trimethoxyphenyl)45dihydro1Hpyrazolo(34b)pyridin6(7H)one
727683309
COC1=CC(=CC(=C1OC)OC)C2CC(=O)N=C3C2=C(NN3)C4=CC=CC=C4
COc1cc(cc(c1OC)OC)C1CC(=O)Nc2c1c(n(nH)2)c1ccccc1
InChI=1SC21H21N3O4c12615913(1016(272)20(15)283)141117(25)222118(14)19(232421)127546812h41014H11H213H3(H222232425)
MFCD06013995
ZINC000013132394
ZINC000013132395

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Available files

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