Vitas-M small molecule compound

methyl N-({4-[3-(1H-indol-3-yl)propanoyl]piperazin-1-yl}carbonyl)-L-valinate

Catalog ID
STK618796
SMILES COC(=O)[C@H](C(C)C)NC(=O)N1CCN(CC1)C(=O)CCc1c[nH]c2c1cccc2

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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 C22H30N4O4 MW 414.50 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H30N4O4/c1-15(2)20(21(28)30-3)24-22(29)26-12-10-25(11-13-26)19(27)9-8-16-14-23-18-7-5-4-6-17(16)18/h4-7,14-15,20,23H,8-13H2,1-3H3,(H,24,29)/t20-/m0/s1
InChIKey
QVLCNIHZRWMJDK-FQEVSTJZSA-N
Synonyms
1014410-63-9
(S)methyl2(4(3(1Hindol3yl)propanoyl)piperazine1carboxamido)3methylbutanoate
1014410639
CC(C)C(C(=O)OC)NC(=O)N1CCN(CC1)C(=O)CCC2=CNC3=CC=CC=C32
COC(=O)(C@H)(C(C)C)NC(=O)N1CCN(CC1)C(=O)CCc1c(nH)c2c1cccc2
InChI=1SC22H30N4O4c115(2)20(21(28)303)2422(29)26121025(111326)19(27)9816142318754617(16)18h4714152023H813H213H3(H2429)t20m0s1
methyl(2S)2((4(3(1Hindol3yl)propanoyl)piperazine1carbonyl)amino)3methylbutanoate
methylN((4(3(1Hindol3yl)propanoyl)piperazin1yl)carbonyl)Lvalinate
MFCD09850555
ZINC000013687802
ZINC13687802

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Available files

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