Vitas-M small molecule compound

[1-(3,4-dimethylphenyl)-1H-1,2,3-triazol-4-yl][4-(4-methylphenyl)piperazin-1-yl]methanone

Catalog ID
STL127472
SMILES Cc1ccc(cc1)N1CCN(CC1)C(=O)c1nnn(c1)c1ccc(c(c1)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 C22H25N5O MW 375.47 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H25N5O/c1-16-4-7-19(8-5-16)25-10-12-26(13-11-25)22(28)21-15-27(24-23-21)20-9-6-17(2)18(3)14-20/h4-9,14-15H,10-13H2,1-3H3
InChIKey
LWGONMHNHGBXSJ-UHFFFAOYSA-N
Synonyms
1326827-04-6
(1(34dimethylphenyl)1H123triazol4yl)(4(4methylphenyl)piperazin1yl)methanone
(1(34dimethylphenyl)triazol4yl)(4(4methylphenyl)piperazin1yl)methanone
1326827046
CC1=CC=C(C=C1)N2CCN(CC2)C(=O)C3=CN(N=N3)C4=CC(=C(C=C4)C)C
InChI=1SC22H25N5Oc1164719(8516)25101226(131125)22(28)211527(242321)209617(2)18(3)1420h491415H1013H213H3
MFCD20740382
ZINC000067263090
ZINC67263090

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Available files

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