Vitas-M small molecule compound

methyl 4-({[2-(4-methoxyphenyl)-4-oxopyrimido[1,2-a]benzimidazol-10(4H)-yl]acetyl}amino)benzoate

Catalog ID
STK884840
SMILES COc1ccc(cc1)c1cc(=O)n2c(n1)n(CC(=O)Nc1ccc(cc1)C(=O)OC)c1c2cccc1

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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 C27H22N4O5 MW 482.50 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H22N4O5/c1-35-20-13-9-17(10-14-20)21-15-25(33)31-23-6-4-3-5-22(23)30(27(31)29-21)16-24(32)28-19-11-7-18(8-12-19)26(34)36-2/h3-15H,16H2,1-2H3,(H,28,32)
InChIKey
ULQMXOLDPSADDF-UHFFFAOYSA-N
Synonyms

COC1=CC=C(C=C1)C2=CC(=O)N3C4=CC=CC=C4N(C3=N2)CC(=O)NC5=CC=C(C=C5)C(=O)OC
InChI=1SC27H22N4O5c1352013917(101420)211525(33)3123643522(23)30(27(31)2921)1624(32)281911718(81219)26(34)362h315H16H212H3(H2832)
methyl4(((2(4methoxyphenyl)4oxopyrimido(12a)benzimidazol10(4H)yl)acetyl)amino)benzoate
methyl4((2(2(4methoxyphenyl)4oxopyrimido(12a)benzimidazol10yl)acetyl)amino)benzoate
MFCD18171756
ZINC000040485200
ZINC40485200

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Available files

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