Vitas-M small molecule compound

methyl 6-(1,4'-bipiperidin-1'-ylmethyl)-4-(2-ethoxyphenyl)-2-oxo-1,2,3,4-tetrahydropyrimidine-5-carboxylate

Catalog ID
STL027986
SMILES CCOc1ccccc1C1NC(=O)NC(=C1C(=O)OC)CN1CCC(CC1)N1CCCCC1

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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 C25H36N4O4 MW 456.59 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H36N4O4/c1-3-33-21-10-6-5-9-19(21)23-22(24(30)32-2)20(26-25(31)27-23)17-28-15-11-18(12-16-28)29-13-7-4-8-14-29/h5-6,9-10,18,23H,3-4,7-8,11-17H2,1-2H3,(H2,26,27,31)
InChIKey
WIFXIAQHKGTJDU-UHFFFAOYSA-N
Synonyms

CCOC1=CC=CC=C1C2C(=C(NC(=O)N2)CN3CCC(CC3)N4CCCCC4)C(=O)OC
InChI=1SC25H36N4O4c1333211065919(21)2322(24(30)322)20(2625(31)2723)1728151118(121628)29137481429h569101823H34781117H212H3(H2262731)
methyl4(2ethoxyphenyl)2oxo6((4piperidin1ylpiperidin1yl)methyl)34dihydro1Hpyrimidine5carboxylate
methyl6(14bipiperidin1ylmethyl)4(2ethoxyphenyl)2oxo1234tetrahydropyrimidine5carboxylate
MFCD18188577
ZINC000057415690
ZINC000057415692

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Available files

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