Vitas-M small molecule compound
ethyl 5-{2-hydroxy-3-[4-(phenylcarbonyl)piperazin-1-yl]propoxy}-1,2-dimethyl-1H-indole-3-carboxylate
Catalog ID
STK944885
SMILES CCOC(=O)c1c(C)n(c2c1cc(OCC(CN1CCN(CC1)C(=O)c1ccccc1)O)cc2)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 C27H33N3O5 MW 479.58 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H33N3O5/c1-4-34-27(33)25-19(2)28(3)24-11-10-22(16-23(24)25)35-18-21(31)17-29-12-14-30(15-13-29)26(32)20-8-6-5-7-9-20/h5-11,16,21,31H,4,12-15,17-18H2,1-3H3InChIKey
RHAFBCOKWHVQFO-UHFFFAOYSA-NSynonyms
CCOC(=O)C1=C(N(C2=C1C=C(C=C2)OCC(CN3CCN(CC3)C(=O)C4=CC=CC=C4)O)C)C
ethyl5(2hydroxy3(4(phenylcarbonyl)piperazin1yl)propoxy)12dimethyl1Hindole3carboxylate
ETHYL5(2HYDROXY3(4(PHENYLCARBONYL)PIPERAZINYL)PROPOXY)12DIMETHYLINDOLE3CARBOXYLATE
ethyl5(3(4benzoylpiperazin1yl)2hydroxypropoxy)12dimethylindole3carboxylate
InChI=1SC27H33N3O5c143427(33)2519(2)28(3)24111022(1623(24)25)351821(31)1729121430(151329)26(32)208657920h511162131H412151718H213H3
MFCD09983191
ZINC000012421908
ZINC000012421909
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