Vitas-M small molecule compound
[4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl][5-(benzyloxy)-1H-indol-3-yl]acetic acid
Catalog ID
STK647326
SMILES OC(=O)C(c1c[nH]c2c1cc(OCc1ccccc1)cc2)N1CCN(CC1)Cc1ccc2c(c1)OCO2
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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 C29H29N3O5 MW 499.57 g/mol Purity >90% as per NMR
InChI
InChI=1S/C29H29N3O5/c33-29(34)28(32-12-10-31(11-13-32)17-21-6-9-26-27(14-21)37-19-36-26)24-16-30-25-8-7-22(15-23(24)25)35-18-20-4-2-1-3-5-20/h1-9,14-16,28,30H,10-13,17-19H2,(H,33,34)InChIKey
KNWDFQRLQRIGNW-UHFFFAOYSA-NSynonyms
1010898-72-2(4(13benzodioxol5ylmethyl)piperazin1yl)(5(benzyloxy)1Hindol3yl)aceticacid
1010898722
2(4(13benzodioxol5ylmethyl)piperazin1yl)2(5phenylmethoxy1Hindol3yl)aceticacid
2(4(benzo(d)(13)dioxol5ylmethyl)piperazin1yl)2(5(benzyloxy)1Hindol3yl)aceticacid
C1CN(CCN1CC2=CC3=C(C=C2)OCO3)C(C4=CNC5=C4C=C(C=C5)OCC6=CC=CC=C6)C(=O)O
InChI=1SC29H29N3O5c3329(34)28(32121031(111332)1721692627(1421)37193626)241630258722(1523(24)25)3518204213520h1914162830H10131719H2(H3334)
MFCD12204092
OC(=O)C(c1c(nH)c2c1cc(OCc1ccccc1)cc2)N1CCN(CC1)Cc1ccc2c(c1)OCO2
ZINC000020713835
ZINC000020713838
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