Vitas-M small molecule compound

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

Catalog ID
STK219921
SMILES COc1cccc(c1)C(=O)Nc1cc(ccc1N1CCN(CC1)C(=O)c1ccccc1)C(=O)OC

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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 C27H27N3O5 MW 473.53 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H27N3O5/c1-34-22-10-6-9-20(17-22)25(31)28-23-18-21(27(33)35-2)11-12-24(23)29-13-15-30(16-14-29)26(32)19-7-4-3-5-8-19/h3-12,17-18H,13-16H2,1-2H3,(H,28,31)
InChIKey
FQQXMTNWECZBOM-UHFFFAOYSA-N
Synonyms

COC1=CC=CC(=C1)C(=O)NC2=C(C=CC(=C2)C(=O)OC)N3CCN(CC3)C(=O)C4=CC=CC=C4
InChI=1SC27H27N3O5c13422106920(1722)25(31)28231821(27(33)352)111224(23)29131530(161429)26(32)197435819h3121718H1316H212H3(H2831)
METHYL3(((3METHOXYPHENYL)CARBONYL)AMINO)4(4(PHENYLCARBONYL)PIPERAZIN1YL)BENZOATE
methyl4(4benzoylpiperazin1yl)3((3methoxybenzoyl)amino)benzoate
MFCD06665410
ZINC000010059875
ZINC10059875

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Available files

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