Vitas-M small molecule compound

(4-methylpiperidin-1-yl)[7-(trifluoromethyl)-5,6-dihydrobenzo[h]pyrazolo[5,1-b]quinazolin-10-yl]methanone

Catalog ID
STL438566
SMILES CC1CCN(CC1)C(=O)c1nn2c(c1)nc1c(c2C(F)(F)F)CCc2c1cccc2

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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 C22H21F3N4O MW 414.43 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H21F3N4O/c1-13-8-10-28(11-9-13)21(30)17-12-18-26-19-15-5-3-2-4-14(15)6-7-16(19)20(22(23,24)25)29(18)27-17/h2-5,12-13H,6-11H2,1H3
InChIKey
QJNTUGILOSOLCX-UHFFFAOYSA-N
Synonyms

(4methylpiperidin1yl)(7(trifluoromethyl)56dihydrobenzo(h)pyrazolo(51b)quinazolin10yl)methanone
CC1CCN(CC1)C(=O)C2=NN3C(=C2)N=C4C(=C3C(F)(F)F)CCC5=CC=CC=C54
InChI=1SC22H21F3N4Oc11381028(11913)21(30)171218261915532414(15)6716(19)20(22(2324)25)29(18)2717h251213H611H21H3
MFCD01528606
ZINC000001413596
ZINC01413596
ZINC1413596

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Available files

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