Vitas-M small molecule compound

methyl 4-[2-methyl-3-(phenylcarbamoyl)-1,4-dihydropyrimido[1,2-a]benzimidazol-4-yl]benzoate

Catalog ID
STK734895
SMILES COC(=O)c1ccc(cc1)C1C(=C(C)Nc2n1c1ccccc1n2)C(=O)Nc1ccccc1

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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 C26H22N4O3 MW 438.49 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H22N4O3/c1-16-22(24(31)28-19-8-4-3-5-9-19)23(17-12-14-18(15-13-17)25(32)33-2)30-21-11-7-6-10-20(21)29-26(30)27-16/h3-15,23H,1-2H3,(H,27,29)(H,28,31)
InChIKey
AQNWCORHMQGEQM-UHFFFAOYSA-N
Synonyms

CC1=C(C(N2C3=CC=CC=C3N=C2N1)C4=CC=C(C=C4)C(=O)OC)C(=O)NC5=CC=CC=C5
InChI=1SC26H22N4O3c11622(24(31)28198435919)23(17121418(151317)25(32)332)302111761020(21)2926(30)2716h31523H12H3(H2729)(H2831)
methyl4(2methyl3(phenylcarbamoyl)14dihydropyrimido(12a)benzimidazol4yl)benzoate
MFCD03855023
ZINC000001060353
ZINC000001060358

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Available files

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