Vitas-M small molecule compound

ethyl 5-{2-hydroxy-3-[(2-phenylethyl)amino]propoxy}-2-methyl-1-(4-methylphenyl)-1H-indole-3-carboxylate

Catalog ID
STK944909
SMILES CCOC(=O)c1c(C)n(c2c1cc(OCC(CNCCc1ccccc1)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 C30H34N2O4 MW 486.61 g/mol Purity >90% as per NMR
InChI
InChI=1S/C30H34N2O4/c1-4-35-30(34)29-22(3)32(24-12-10-21(2)11-13-24)28-15-14-26(18-27(28)29)36-20-25(33)19-31-17-16-23-8-6-5-7-9-23/h5-15,18,25,31,33H,4,16-17,19-20H2,1-3H3
InChIKey
NFYWDHWHSCOMRN-UHFFFAOYSA-N
Synonyms

CCOC(=O)C1=C(N(C2=C1C=C(C=C2)OCC(CNCCC3=CC=CC=C3)O)C4=CC=C(C=C4)C)C
ethyl5(2hydroxy3((2phenylethyl)amino)propoxy)2methyl1(4methylphenyl)1Hindole3carboxylate
ETHYL5(2HYDROXY3((2PHENYLETHYL)AMINO)PROPOXY)2METHYL1(4METHYLPHENYL)INDOLE3CARBOXYLATE
ethyl5(2hydroxy3(2phenylethylamino)propoxy)2methyl1(4methylphenyl)indole3carboxylate
ETHYL5(2HYDROXY3(PHENETHYLAMINO)PROPOXY)2METHYL1(4METHYLPHENYL)INDOLE3CARBOXYLATE
InChI=1SC30H34N2O4c143530(34)2922(3)32(24121021(2)111324)28151426(1827(28)29)362025(33)19311716238657923h51518253133H416171920H213H3
MFCD03130465
ZINC000003635843
ZINC000003635845

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Available files

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