Vitas-M small molecule compound
(5-bromo-1H-indol-3-yl)[4-(pyridin-2-ylmethyl)piperazin-1-yl]acetic acid
Catalog ID
STL233637
SMILES OC(=O)C(c1c[nH]c2c1cc(Br)cc2)N1CCN(CC1)Cc1ccccn1
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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 C20H21BrN4O2 MW 429.32 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H21BrN4O2/c21-14-4-5-18-16(11-14)17(12-23-18)19(20(26)27)25-9-7-24(8-10-25)13-15-3-1-2-6-22-15/h1-6,11-12,19,23H,7-10,13H2,(H,26,27)InChIKey
BHQSQFULXCDKEQ-UHFFFAOYSA-NSynonyms
1081135-68-3(5bromo1Hindol3yl)(4(pyridin2ylmethyl)piperazin1yl)aceticacid
1081135683
2(5bromo1Hindol3yl)2(4(pyridin2ylmethyl)piperazin1yl)aceticacid
C1CN(CCN1CC2=CC=CC=N2)C(C3=CNC4=C3C=C(C=C4)Br)C(=O)O
InChI=1SC20H21BrN4O2c2114451816(1114)17(122318)19(20(26)27)259724(81025)131531262215h1611121923H71013H2(H2627)
MFCD12207323
OC(=O)C(c1c(nH)c2c1cc(Br)cc2)N1CCN(CC1)Cc1ccccn1
ZINC000020726946
ZINC000020726950
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