Vitas-M small molecule compound

methyl 3-[(biphenyl-4-ylcarbonyl)amino]-4-(4-methylpiperazin-1-yl)benzoate

Catalog ID
STK344760
SMILES COC(=O)c1ccc(c(c1)NC(=O)c1ccc(cc1)c1ccccc1)N1CCN(CC1)C

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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 C26H27N3O3 MW 429.52 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H27N3O3/c1-28-14-16-29(17-15-28)24-13-12-22(26(31)32-2)18-23(24)27-25(30)21-10-8-20(9-11-21)19-6-4-3-5-7-19/h3-13,18H,14-17H2,1-2H3,(H,27,30)
InChIKey
KSSKCUHLYVQVHO-UHFFFAOYSA-N
Synonyms

CN1CCN(CC1)C2=C(C=C(C=C2)C(=O)OC)NC(=O)C3=CC=C(C=C3)C4=CC=CC=C4
InChI=1SC26H27N3O3c128141629(171528)24131222(26(31)322)1823(24)2725(30)2110820(91121)196435719h31318H1417H212H3(H2730)
METHYL3(((11BIPHENYL)4YLCARBONYL)AMINO)4(4METHYL1PIPERAZINYL)BENZOATE
methyl3((biphenyl4ylcarbonyl)amino)4(4methylpiperazin1yl)benzoate
METHYL4(4METHYLPIPERAZIN1YL)3((4PHENYLBENZOYL)AMINO)BENZOATE
MFCD06633349
ZINC000012855551
ZINC12855551

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Available files

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