Vitas-M small molecule compound
[1-(carboxymethyl)-1H-indol-3-yl]{4-[2-oxo-2-(pyrrolidin-1-yl)ethyl]piperazin-1-yl}acetic acid
Catalog ID
STK656168
SMILES OC(=O)Cn1cc(c2c1cccc2)C(N1CCN(CC1)CC(=O)N1CCCC1)C(=O)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 C22H28N4O5 MW 428.49 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H28N4O5/c27-19(24-7-3-4-8-24)14-23-9-11-25(12-10-23)21(22(30)31)17-13-26(15-20(28)29)18-6-2-1-5-16(17)18/h1-2,5-6,13,21H,3-4,7-12,14-15H2,(H,28,29)(H,30,31)InChIKey
KIQHVXKXTMTKIN-UHFFFAOYSA-NSynonyms
1214698-08-4(1(carboxymethyl)1Hindol3yl)(4(2oxo2(pyrrolidin1yl)ethyl)piperazin1yl)aceticacid
1214698084
2(1(carboxymethyl)1Hindol3yl)2(4(2oxo2(pyrrolidin1yl)ethyl)piperazin1yl)aceticacid
2(1(carboxymethyl)indol3yl)2(4(2oxo2pyrrolidin1ylethyl)piperazin1yl)aceticacid
C1CCN(C1)C(=O)CN2CCN(CC2)C(C3=CN(C4=CC=CC=C43)CC(=O)O)C(=O)O
InChI=1SC22H28N4O5c2719(24734824)142391125(121023)21(22(30)31)171326(1520(28)29)18621516(17)18h12561321H347121415H2(H2829)(H3031)
MFCD13760491
ZINC000036365680
ZINC000036365682
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