Vitas-M small molecule compound

1,1'-[(4,6-dipropoxybenzene-1,3-diyl)diprop-1-yne-1,3-diyl]dipiperidine

Catalog ID
STL483250
SMILES CCCOc1cc(OCCC)c(cc1C#CCN1CCCCC1)C#CCN1CCCCC1

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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 C28H40N2O2 MW 436.64 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H40N2O2/c1-3-21-31-27-24-28(32-22-4-2)26(14-12-20-30-17-9-6-10-18-30)23-25(27)13-11-19-29-15-7-5-8-16-29/h23-24H,3-10,15-22H2,1-2H3
InChIKey
CSSVNXGJNGGIQG-UHFFFAOYSA-N
Synonyms

1(3(5(3PIPERIDIN1YLPROP1YNYL)24DIPROPOXYPHENYL)PROP2YNYL)PIPERIDINE
11((46dipropoxybenzene13diyl)diprop1yne13diyl)dipiperidine
CCCOC1=CC(=C(C=C1C#CCN2CCCCC2)C#CCN3CCCCC3)OCCC
InChI=1SC28H40N2O2c132131272428(322242)26(141220301796101830)2325(27)13111929157581629h2324H3101522H212H3
MFCD30713441
ZINC000002896317
ZINC2896317

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Available files

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