Vitas-M small molecule compound
methyl 4-{2,5-dioxo-3-[4-(3-phenylpropyl)piperazin-1-yl]pyrrolidin-1-yl}benzoate
Catalog ID
STK224690
SMILES COC(=O)c1ccc(cc1)N1C(=O)CC(C1=O)N1CCN(CC1)CCCc1ccccc1
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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 C25H29N3O4 MW 435.52 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H29N3O4/c1-32-25(31)20-9-11-21(12-10-20)28-23(29)18-22(24(28)30)27-16-14-26(15-17-27)13-5-8-19-6-3-2-4-7-19/h2-4,6-7,9-12,22H,5,8,13-18H2,1H3InChIKey
YCCVJUXTHYEAOU-UHFFFAOYSA-NSynonyms
COC(=O)C1=CC=C(C=C1)N2C(=O)CC(C2=O)N3CCN(CC3)CCCC4=CC=CC=C4
InChI=1SC25H29N3O4c13225(31)2091121(121020)2823(29)1822(24(28)30)27161426(151727)1358196324719h246791222H581318H21H3
methyl4(25dioxo3(4(3phenylpropyl)piperazin1yl)pyrrolidin1yl)benzoate
MFCD07657726
ZINC000022782357
ZINC000100215998
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