Vitas-M small molecule compound

[4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl][7-(difluoromethyl)-5-phenylpyrazolo[1,5-a]pyrimidin-3-yl]methanone

Catalog ID
STL405515
SMILES O=C(c1cnn2c1nc(cc2C(F)F)c1ccccc1)N1CCN(CC1)Cc1ccc2c(c1)OCO2

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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 C26H23F2N5O3 MW 491.50 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H23F2N5O3/c27-24(28)21-13-20(18-4-2-1-3-5-18)30-25-19(14-29-33(21)25)26(34)32-10-8-31(9-11-32)15-17-6-7-22-23(12-17)36-16-35-22/h1-7,12-14,24H,8-11,15-16H2
InChIKey
XOKVAQCOFZYPAN-UHFFFAOYSA-N
Synonyms
677781-51-0
(4(13benzodioxol5ylmethyl)piperazin1yl)(7(difluoromethyl)5phenylpyrazolo(15a)pyrimidin3yl)methanone
677781510
C1CN(CCN1CC2=CC3=C(C=C2)OCO3)C(=O)C4=C5N=C(C=C(N5N=C4)C(F)F)C6=CC=CC=C6
InChI=1SC26H23F2N5O3c2724(28)211320(184213518)302519(142933(21)25)26(34)3210831(91132)1517672223(1217)36163522h17121424H8111516H2
MFCD04049889
ZINC000015989361
ZINC15989361

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Available files

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