Vitas-M small molecule compound

ethyl 5-hydroxy-2-{[4-(2-methylphenyl)piperazin-1-yl]methyl}-1-phenyl-1H-indole-3-carboxylate

Catalog ID
STK049305
SMILES CCOC(=O)c1c(CN2CCN(CC2)c2ccccc2C)n(c2c1cc(O)cc2)c1ccccc1

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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 C29H31N3O3 MW 469.58 g/mol Purity >90% as per NMR
InChI
InChI=1S/C29H31N3O3/c1-3-35-29(34)28-24-19-23(33)13-14-26(24)32(22-10-5-4-6-11-22)27(28)20-30-15-17-31(18-16-30)25-12-8-7-9-21(25)2/h4-14,19,33H,3,15-18,20H2,1-2H3
InChIKey
QYILPFILVRHENT-UHFFFAOYSA-N
Synonyms

CCOC(=O)C1=C(N(C2=C1C=C(C=C2)O)C3=CC=CC=C3)CN4CCN(CC4)C5=CC=CC=C5C
CCOC(=O)c1c(CN2CCN(CC2)c2ccccc2C)n(c2c1cc(O)cc2)c1ccccc1
ETHYL5HYDROXY2((4(2METHYLPHENYL)PIPERAZIN1YL)METHYL)1PHENYL1HINDOLE3CARBOXYLATE
ETHYL5HYDROXY2((4(2METHYLPHENYL)PIPERAZIN1YL)METHYL)1PHENYLINDOLE3CARBOXYLATE
ETHYL5HYDROXY2((4(2METHYLPHENYL)PIPERAZINYL)METHYL)1PHENYLINDOLE3CARBOXYLATE
InChI=1SC29H31N3O3c133529(34)28241923(33)131426(24)32(22105461122)27(28)2030151731(181630)251287921(25)2h4141933H3151820H212H3
MFCD01988732
STK049305
ZINC000054959646
ZINC54959646

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Available files

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