Vitas-M small molecule compound

methyl 5-hydroxy-2-methyl-1-{2-[4-(2-phenylpropan-2-yl)phenoxy]ethyl}-1H-indole-3-carboxylate

Catalog ID
STK765104
SMILES COC(=O)c1c(C)n(c2c1cc(O)cc2)CCOc1ccc(cc1)C(c1ccccc1)(C)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 C28H29NO4 MW 443.54 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H29NO4/c1-19-26(27(31)32-4)24-18-22(30)12-15-25(24)29(19)16-17-33-23-13-10-21(11-14-23)28(2,3)20-8-6-5-7-9-20/h5-15,18,30H,16-17H2,1-4H3
InChIKey
LJGZTNTUJLZFKW-UHFFFAOYSA-N
Synonyms

CC1=C(C2=C(N1CCOC3=CC=C(C=C3)C(C)(C)C4=CC=CC=C4)C=CC(=C2)O)C(=O)OC
InChI=1SC28H29NO4c11926(27(31)324)241822(30)121525(24)29(19)16173323131021(111423)28(23)208657920h5151830H1617H214H3
METHYL5HYDROXY2METHYL1(2(4(1METHYL1PHENYLETHYL)PHENOXY)ETHYL)1HINDOLE3CARBOXYLATE
METHYL5HYDROXY2METHYL1(2(4(1METHYL1PHENYLETHYL)PHENOXY)ETHYL)INDOLE3CARBOXYLATE
methyl5hydroxy2methyl1(2(4(2phenylpropan2yl)phenoxy)ethyl)1Hindole3carboxylate
METHYL5HYDROXY2METHYL1(2(4(2PHENYLPROPAN2YL)PHENOXY)ETHYL)INDOLE3CARBOXYLATE
MFCD02852890
ZINC000000717183
ZINC00717183
ZINC717183

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Available files

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