Vitas-M small molecule compound

2,4,5,6,7,8-hexahydrocyclohepta[c]pyrazol-3-yl{4-[5-(trifluoromethyl)pyridin-2-yl]piperazin-1-yl}methanone

Catalog ID
STL421607
SMILES O=C(c1[nH]nc2c1CCCCC2)N1CCN(CC1)c1ccc(cn1)C(F)(F)F

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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 C19H22F3N5O MW 393.41 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H22F3N5O/c20-19(21,22)13-6-7-16(23-12-13)26-8-10-27(11-9-26)18(28)17-14-4-2-1-3-5-15(14)24-25-17/h6-7,12H,1-5,8-11H2,(H,24,25)
InChIKey
HDGDEVQCPTXYTG-UHFFFAOYSA-N
Synonyms
1574294-55-5
(145678hexahydrocyclohepta(c)pyrazol3yl)(4(5(trifluoromethyl)pyridin2yl)piperazin1yl)methanone
145678hexahydrocyclohepta(c)pyrazol3yl(4(5(trifluoromethyl)pyridin2yl)piperazin1yl)methanone
1574294555
245678hexahydrocyclohepta(c)pyrazol3yl(4(5(trifluoromethyl)pyridin2yl)piperazin1yl)methanone
C1CCC2=C(CC1)NN=C2C(=O)N3CCN(CC3)C4=NC=C(C=C4)C(F)(F)F
InChI=1SC19H22F3N5Oc2019(2122)136716(231213)2681027(11926)18(28)17144213515(14)242517h6712H15811H2(H2425)
MFCD30707638
O=C(c1(nH)nc2c1CCCCC2)N1CCN(CC1)c1ccc(cn1)C(F)(F)F
O=C(c1n(nH)c2c1CCCCC2)N1CCN(CC1)c1ccc(cn1)C(F)(F)F
ZINC000096231736
ZINC96231736

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Available files

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