Vitas-M small molecule compound

(4-benzylpiperazin-1-yl)(1,3,6-trimethyl-1H-pyrazolo[3,4-b]pyridin-4-yl)methanone

Catalog ID
STL252019
SMILES Cc1cc(C(=O)N2CCN(CC2)Cc2ccccc2)c2c(n1)n(C)nc2C

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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 C21H25N5O MW 363.46 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H25N5O/c1-15-13-18(19-16(2)23-24(3)20(19)22-15)21(27)26-11-9-25(10-12-26)14-17-7-5-4-6-8-17/h4-8,13H,9-12,14H2,1-3H3
InChIKey
VVDVRXFFDWQMSF-UHFFFAOYSA-N
Synonyms
938781-77-2
(4benzylpiperazin1yl)(136trimethyl1Hpyrazolo(34b)pyridin4yl)methanone
(4benzylpiperazin1yl)(136trimethylpyrazolo(34b)pyridin4yl)methanone
938781772
CC1=NC2=C(C(=NN2C)C)C(=C1)C(=O)N3CCN(CC3)CC4=CC=CC=C4
InChI=1SC21H25N5Oc1151318(1916(2)2324(3)20(19)2215)21(27)2611925(101226)14177546817h4813H91214H213H3
MFCD09528240
ZINC000014898549
ZINC14898549

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Available files

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