Vitas-M small molecule compound

4-oxo-4-[4-(tricyclo[3.3.1.1~3,7~]dec-1-yl)piperazin-1-yl]butanoic acid

Catalog ID
STK470522
SMILES O=C(N1CCN(CC1)C12CC3CC(C2)CC(C1)C3)CCC(=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 C18H28N2O3 MW 320.43 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H28N2O3/c21-16(1-2-17(22)23)19-3-5-20(6-4-19)18-10-13-7-14(11-18)9-15(8-13)12-18/h13-15H,1-12H2,(H,22,23)
InChIKey
JTZQIXLTOFNDKN-UHFFFAOYSA-N
Synonyms

4(4(1adamantyl)piperazin1yl)4oxobutanoicacid
4(4ADAMANTANYLPIPERAZINYL)4OXOBUTANOICACID
4oxo4(4(tricyclo(3311~37~)dec1yl)piperazin1yl)butanoicacid
C1CN(CCN1C(=O)CCC(=O)O)C23CC4CC(C2)CC(C4)C3
InChI=1SC18H28N2O3c2116(1217(22)23)193520(6419)181013714(1118)915(813)1218h1315H112H2(H2223)
MFCD07625675
ZINC000017055383
ZINC17055383

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Available files

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