Vitas-M small molecule compound

1-{1-[4-(benzyloxy)-3-methoxybenzyl]piperidin-4-yl}azepane

Catalog ID
STK171336
SMILES COc1cc(ccc1OCc1ccccc1)CN1CCC(CC1)N1CCCCCC1

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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 C26H36N2O2 MW 408.58 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H36N2O2/c1-29-26-19-23(11-12-25(26)30-21-22-9-5-4-6-10-22)20-27-17-13-24(14-18-27)28-15-7-2-3-8-16-28/h4-6,9-12,19,24H,2-3,7-8,13-18,20-21H2,1H3
InChIKey
COBVEBUHCGAGAS-UHFFFAOYSA-N
Synonyms

1(1((3METHOXY4PHENYLMETHOXYPHENYL)METHYL)PIPERIDIN4YL)AZEPANE
1(1(4(BENZYLOXY)3METHOXYBENZYL)PIPERIDIN4YL)AZEPANE
1(1(4(benzyloxy)3methoxybenzyl)piperidin4yl)azepaneoxalate
COC1=C(C=CC(=C1)CN2CCC(CC2)N3CCCCCC3)OCC4=CC=CC=C4
InChI=1SC26H36N2O2c129261923(111225(26)30212295461022)2027171324(141827)281572381628h469121924H237813182021H21H3
MFCD03142753
OC(=O)C(=O)OCOc1cc(ccc1OCc1ccccc1)CN1CCC(CC1)N1CCCCCC1
ZINC000004703443
ZINC4703443

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Available files

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