Vitas-M small molecule compound
ethyl 5-{2-hydroxy-3-[4-(4-methylphenyl)piperazin-1-yl]propoxy}-2-methyl-1-(4-methylphenyl)-1H-indole-3-carboxylate
Catalog ID
STK944918
SMILES CCOC(=O)c1c(C)n(c2c1cc(OCC(CN1CCN(CC1)c1ccc(cc1)C)O)cc2)c1ccc(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 C33H39N3O4 MW 541.69 g/mol Purity >90% as per NMR
InChI
InChI=1S/C33H39N3O4/c1-5-39-33(38)32-25(4)36(27-12-8-24(3)9-13-27)31-15-14-29(20-30(31)32)40-22-28(37)21-34-16-18-35(19-17-34)26-10-6-23(2)7-11-26/h6-15,20,28,37H,5,16-19,21-22H2,1-4H3InChIKey
FXBYVFHUZBOXOY-UHFFFAOYSA-NSynonyms
CCOC(=O)C1=C(N(C2=C1C=C(C=C2)OCC(CN3CCN(CC3)C4=CC=C(C=C4)C)O)C5=CC=C(C=C5)C)C
ethyl5(2hydroxy3(4(4methylphenyl)piperazin1yl)propoxy)2methyl1(4methylphenyl)1Hindole3carboxylate
ethyl5(2hydroxy3(4(4methylphenyl)piperazin1yl)propoxy)2methyl1(4methylphenyl)indole3carboxylate
ETHYL5(2HYDROXY3(4(4METHYLPHENYL)PIPERAZINYL)PROPOXY)2METHYL1(4METHYLPHENYL)INDOLE3CARBOXYLATE
InChI=1SC33H39N3O4c153933(38)3225(4)36(2712824(3)91327)31151429(2030(31)32)402228(37)2134161835(191734)2610623(2)71126h615202837H516192122H214H3
MFCD03130513
ZINC000101222486
ZINC000101222490
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