Vitas-M small molecule compound

{4-[(1-ethyl-3-methyl-1H-pyrazol-4-yl)methyl]piperazin-1-yl}[2-(1-ethyl-3-methyl-1H-pyrazol-4-yl)quinolin-4-yl]methanone

Catalog ID
STK311175
SMILES CCn1nc(c(c1)CN1CCN(CC1)C(=O)c1cc(nc2c1cccc2)c1cn(nc1C)CC)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 C27H33N7O MW 471.61 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H33N7O/c1-5-33-17-21(19(3)29-33)16-31-11-13-32(14-12-31)27(35)23-15-26(24-18-34(6-2)30-20(24)4)28-25-10-8-7-9-22(23)25/h7-10,15,17-18H,5-6,11-14,16H2,1-4H3
InChIKey
XIPPZRQHIQQYBB-UHFFFAOYSA-N
Synonyms

(4((1ethyl3methyl1Hpyrazol4yl)methyl)piperazin1yl)(2(1ethyl3methyl1Hpyrazol4yl)quinolin4yl)methanone
(4((1ethyl3methylpyrazol4yl)methyl)piperazin1yl)(2(1ethyl3methylpyrazol4yl)quinolin4yl)methanone
CCN1C=C(C(=N1)C)CN2CCN(CC2)C(=O)C3=CC(=NC4=CC=CC=C43)C5=CN(N=C5C)CC
InChI=1SC27H33N7Oc15331721(19(3)2933)1631111332(141231)27(35)231526(241834(62)3020(24)4)28251087922(23)25h710151718H56111416H214H3
MFCD04059307
ZINC000013960177
ZINC13960177

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Available files

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