Vitas-M small molecule compound

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

Catalog ID
STK773470
SMILES CCOC(=O)N1CCN(CC1)Cc1n(c2ccccc2)c2c(c1C(=O)OCC)cc(cc2)O

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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 C25H29N3O5 MW 451.52 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H29N3O5/c1-3-32-24(30)23-20-16-19(29)10-11-21(20)28(18-8-6-5-7-9-18)22(23)17-26-12-14-27(15-13-26)25(31)33-4-2/h5-11,16,29H,3-4,12-15,17H2,1-2H3
InChIKey
SBFBAVUVXPSIDS-UHFFFAOYSA-N
Synonyms

CCOC(=O)C1=C(N(C2=C1C=C(C=C2)O)C3=CC=CC=C3)CN4CCN(CC4)C(=O)OCC
ethyl2((4(ethoxycarbonyl)piperazin1yl)methyl)5hydroxy1phenyl1Hindole3carboxylate
ETHYL2((4ETHOXYCARBONYLPIPERAZIN1YL)METHYL)5HYDROXY1PHENYLINDOLE3CARBOXYLATE
InChI=1SC25H29N3O5c133224(30)23201619(29)101121(20)28(188657918)22(23)1726121427(151326)25(31)3342h5111629H34121517H212H3
MFCD03352850
ZINC000019856853
ZINC19856853

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Available files

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