Vitas-M small molecule compound

2-[4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]-1-(5-phenyl-4,5-dihydro-1H-pyrazol-1-yl)ethanone

Catalog ID
STK210310
SMILES O=C(N1N=CCC1c1ccccc1)CN1CCN(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 C23H26N4O3 MW 406.48 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H26N4O3/c28-23(27-20(8-9-24-27)19-4-2-1-3-5-19)16-26-12-10-25(11-13-26)15-18-6-7-21-22(14-18)30-17-29-21/h1-7,9,14,20H,8,10-13,15-17H2
InChIKey
DHGZNLGGJKUTOC-UHFFFAOYSA-N
Synonyms
727392-14-5
2(4(13BENZODIOXOL5YLMETHYL)PIPERAZIN1YL)1((5R)5PHENYL45DIHYDRO1HPYRAZOL1YL)ETHANONE
2(4(13BENZODIOXOL5YLMETHYL)PIPERAZIN1YL)1((5S)5PHENYL45DIHYDRO1HPYRAZOL1YL)ETHANONE
2(4(13BENZODIOXOL5YLMETHYL)PIPERAZIN1YL)1(3PHENYL34DIHYDROPYRAZOL2YL)ETHANONE
2(4(13benzodioxol5ylmethyl)piperazin1yl)1(5phenyl45dihydro1Hpyrazol1yl)ethanone
2(4(2HBENZO(34D)13DIOXOLAN5YLMETHYL)PIPERAZINYL)1(5PHENYL(2PYRAZOLINYL))ETHAN1ONE
2(4(benzo(d)(13)dioxol5ylmethyl)piperazin1yl)1(5phenyl45dihydro1Hpyrazol1yl)ethanone
727392145
C1CN(CCN1CC2=CC3=C(C=C2)OCO3)CC(=O)N4C(CC=N4)C5=CC=CC=C5
InChI=1SC23H26N4O3c2823(2720(892427)194213519)1626121025(111326)1518672122(1418)30172921h1791420H810131517H2
MFCD06192720
ZINC000019899456
ZINC000019899457

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Available files

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