Vitas-M small molecule compound

[3,4-dimethyl-2-(1H-tetrazol-1-yl)phenyl]{4-[2-(pyridin-2-yl)ethyl]piperazin-1-yl}methanone

Catalog ID
STL312486
SMILES O=C(c1ccc(c(c1n1cnnn1)C)C)N1CCN(CC1)CCc1ccccn1

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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 C21H25N7O MW 391.48 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H25N7O/c1-16-6-7-19(20(17(16)2)28-15-23-24-25-28)21(29)27-13-11-26(12-14-27)10-8-18-5-3-4-9-22-18/h3-7,9,15H,8,10-14H2,1-2H3
InChIKey
PNTKPBRNZINWMA-UHFFFAOYSA-N
Synonyms
1401601-55-5
(34dimethyl2(1Htetrazol1yl)phenyl)(4(2(pyridin2yl)ethyl)piperazin1yl)methanone
(34dimethyl2(tetrazol1yl)phenyl)(4(2pyridin2ylethyl)piperazin1yl)methanone
1401601555
CC1=C(C(=C(C=C1)C(=O)N2CCN(CC2)CCC3=CC=CC=N3)N4C=NN=N4)C
InChI=1SC21H25N7Oc1166719(20(17(16)2)281523242528)21(29)27131126(121427)1081853492218h37915H81014H212H3
MFCD22581907
ZINC000079473826
ZINC79473826

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Available files

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