Vitas-M small molecule compound

methyl 4-(4-benzylpiperazin-1-yl)-3-{[(2-methoxyphenyl)carbonyl]amino}benzoate

Catalog ID
STK195151
SMILES COC(=O)c1ccc(c(c1)NC(=O)c1ccccc1OC)N1CCN(CC1)Cc1ccccc1

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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 C27H29N3O4 MW 459.55 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H29N3O4/c1-33-25-11-7-6-10-22(25)26(31)28-23-18-21(27(32)34-2)12-13-24(23)30-16-14-29(15-17-30)19-20-8-4-3-5-9-20/h3-13,18H,14-17,19H2,1-2H3,(H,28,31)
InChIKey
JUUJHTGZOWXQJV-UHFFFAOYSA-N
Synonyms

COC1=CC=CC=C1C(=O)NC2=C(C=CC(=C2)C(=O)OC)N3CCN(CC3)CC4=CC=CC=C4
InChI=1SC27H29N3O4c1332511761022(25)26(31)28231821(27(32)342)121324(23)30161429(151730)19208435920h31318H141719H212H3(H2831)
METHYL4(4BENZYL1PIPERAZINYL)3((2METHOXYBENZOYL)AMINO)BENZOATE
METHYL4(4BENZYLPIPERAZIN1YL)3(((2METHOXYPHENYL)CARBONYL)AMINO)BENZOATE
methyl4(4benzylpiperazin1yl)3((2methoxybenzoyl)amino)benzoate
MFCD06665615
ZINC000057222709
ZINC57222709

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Available files

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