Vitas-M small molecule compound

2-[4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]-6-methyl-5-(naphthalen-1-ylmethyl)pyrimidin-4(3H)-one

Catalog ID
STK211099
SMILES Cc1nc([nH]c(=O)c1Cc1cccc2c1cccc2)N1CCN(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 C28H28N4O3 MW 468.56 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H28N4O3/c1-19-24(16-22-7-4-6-21-5-2-3-8-23(21)22)27(33)30-28(29-19)32-13-11-31(12-14-32)17-20-9-10-25-26(15-20)35-18-34-25/h2-10,15H,11-14,16-18H2,1H3,(H,29,30,33)
InChIKey
KQNXWEFXYXRXJD-UHFFFAOYSA-N
Synonyms
878974-51-7
2(4(13BENZODIOXOL5YLMETHYL)1PIPERAZINYL)6METHYL5(1NAPHTHYLMETHYL)4(3H)PYRIMIDINONE
2(4(13BENZODIOXOL5YLMETHYL)PIPERAZIN1YL)6METHYL5(NAPHTHALEN1YLMETHYL)1HPYRIMIDIN4ONE
2(4(13benzodioxol5ylmethyl)piperazin1yl)6methyl5(naphthalen1ylmethyl)pyrimidin4(3H)one
2(4(2HBENZO(34D)13DIOXOLAN5YLMETHYL)PIPERAZINYL)6METHYL5(NAPHTHYLMETHYL)3HYDROPYRIMIDIN4ONE
2(4(benzo(d)(13)dioxol5ylmethyl)piperazin1yl)6methyl5(naphthalen1ylmethyl)pyrimidin4(3H)one
878974517
CC1=C(C(=O)N=C(N1)N2CCN(CC2)CC3=CC4=C(C=C3)OCO4)CC5=CC=CC6=CC=CC=C65
Cc1nc((nH)c(=O)c1Cc1cccc2c1cccc2)N1CCN(CC1)Cc1ccc2c(c1)OCO2
InChI=1SC28H28N4O3c11924(162274621523823(21)22)27(33)3028(2919)32131131(121432)17209102526(1520)35183425h21015H11141618H21H3(H293033)
MFCD06754738
ZINC9356814

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Available files

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