Vitas-M small molecule compound

ethyl 2-[4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]-4-oxo-6-phenyl-1,4,5,6-tetrahydropyrimidine-5-carboxylate

Catalog ID
STK210557
SMILES CCOC(=O)C1C(=O)N=C(NC1c1ccccc1)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 C25H28N4O5 MW 464.52 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H28N4O5/c1-2-32-24(31)21-22(18-6-4-3-5-7-18)26-25(27-23(21)30)29-12-10-28(11-13-29)15-17-8-9-19-20(14-17)34-16-33-19/h3-9,14,21-22H,2,10-13,15-16H2,1H3,(H,26,27,30)
InChIKey
ZITHJOUPPHLFMP-UHFFFAOYSA-N
Synonyms
727385-43-5
727385435
CCOC(=O)C1C(N=C(NC1=O)N2CCN(CC2)CC3=CC4=C(C=C3)OCO4)C5=CC=CC=C5
ethyl2(4(13benzodioxol5ylmethyl)piperazin1yl)4oxo6phenyl1456tetrahydropyrimidine5carboxylate
ETHYL2(4(13BENZODIOXOL5YLMETHYL)PIPERAZIN1YL)6OXO4PHENYL45DIHYDRO1HPYRIMIDINE5CARBOXYLATE
ETHYL2(4(2HBENZO(34D)13DIOXOLAN5YLMETHYL)PIPERAZINYL)6OXO4PHENYL345TRIHYDROPYRIMIDINE5CARBOXYLATE
ethyl2(4(benzo(d)(13)dioxol5ylmethyl)piperazin1yl)4oxo6phenyl1456tetrahydropyrimidine5carboxylate
InChI=1SC25H28N4O5c123224(31)2122(186435718)2625(2723(21)30)29121028(111329)1517891920(1417)34163319h39142122H210131516H21H3(H262730)
MFCD06193715
ZINC000019899529
ZINC000019899535

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Available files

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