Vitas-M small molecule compound

[5-(3,4-dichlorophenyl)-7-(trifluoromethyl)pyrazolo[1,5-a]pyrimidin-2-yl][4-(2-methoxyphenyl)piperazin-1-yl]methanone

Catalog ID
STK761896
SMILES COc1ccccc1N1CCN(CC1)C(=O)c1nn2c(c1)nc(cc2C(F)(F)F)c1ccc(c(c1)Cl)Cl

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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 C25H20Cl2F3N5O2 MW 550.37 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H20Cl2F3N5O2/c1-37-21-5-3-2-4-20(21)33-8-10-34(11-9-33)24(36)19-14-23-31-18(15-6-7-16(26)17(27)12-15)13-22(25(28,29)30)35(23)32-19/h2-7,12-14H,8-11H2,1H3
InChIKey
YCOGWHZFCMARAH-UHFFFAOYSA-N
Synonyms
313397-29-4
(5(34DICHLOROPHENYL)7(TRIFLUOROMETHYL)PYRAZOLO(15A)PYRIMIDIN2YL)(4(2METHOXYPHENYL)PIPERAZIN1YL)METHANONE
2(4((5(34DICHLOROPHENYL)7(TRIFLUOROMETHYL)PYRAZOLO(15A)PYRIMIDIN2YL)CARBONYL)1PIPERAZINYL)PHENYLMETHYLETHER
313397294
5(34DICHLOROPHENYL)7(TRIFLUOROMETHYL)(8HYDROPYRAZOLO(15A)PYRIMIDIN2YL)4(2METHOXYPHENYL)PIPERAZINYLKETONE
COC1=CC=CC=C1N2CCN(CC2)C(=O)C3=NN4C(=CC(=NC4=C3)C5=CC(=C(C=C5)Cl)Cl)C(F)(F)F
InChI=1SC25H20Cl2F3N5O2c13721532420(21)3381034(11933)24(36)1914233118(156716(26)17(27)1215)1322(25(2829)30)35(23)3219h271214H811H21H3
MFCD01528452
ZINC000000669550
ZINC00669550
ZINC669550

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Available files

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