Vitas-M small molecule compound

3-{2-[4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]-2-oxoethyl}quinazolin-4(3H)-one

Catalog ID
STL349905
SMILES O=C(N1CCN(CC1)Cc1ccc2c(c1)OCO2)Cn1cnc2c(c1=O)cccc2

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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 C22H22N4O4 MW 406.44 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H22N4O4/c27-21(13-26-14-23-18-4-2-1-3-17(18)22(26)28)25-9-7-24(8-10-25)12-16-5-6-19-20(11-16)30-15-29-19/h1-6,11,14H,7-10,12-13,15H2
InChIKey
IRTKIYUNXYEDTQ-UHFFFAOYSA-N
Synonyms
757199-20-5
3(2(4(13BENZODIOXOL5YLMETHYL)1PIPERAZINYL)2OXOETHYL)4(3H)QUINAZOLINONE
3(2(4(13benzodioxol5ylmethyl)piperazin1yl)2oxoethyl)quinazolin4(3H)one
3(2(4(13BENZODIOXOL5YLMETHYL)PIPERAZIN1YL)2OXOETHYL)QUINAZOLIN4ONE
3(2(4(benzo(d)(13)dioxol5ylmethyl)piperazin1yl)2oxoethyl)quinazolin4(3H)one
757199205
C1CN(CCN1CC2=CC3=C(C=C2)OCO3)C(=O)CN4C=NC5=CC=CC=C5C4=O
InChI=1SC22H22N4O4c2721(1326142318421317(18)22(26)28)259724(81025)1216561920(1116)30152919h161114H710121315H2
MFCD06342385
ZINC000020591835
ZINC20591835

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Available files

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