Vitas-M small molecule compound

N-{5-chloro-2-[(2-fluorobenzyl)oxy]benzyl}-1-(tricyclo[3.3.1.1~3,7~]dec-1-yl)ethanamine

Catalog ID
STL507952
SMILES Clc1ccc(c(c1)CNC(C12CC3CC(C2)CC(C1)C3)C)OCc1ccccc1F

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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 C26H31ClFNO MW 427.99 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H31ClFNO/c1-17(26-12-18-8-19(13-26)10-20(9-18)14-26)29-15-22-11-23(27)6-7-25(22)30-16-21-4-2-3-5-24(21)28/h2-7,11,17-20,29H,8-10,12-16H2,1H3
InChIKey
DPTIMYNFFUCOND-UHFFFAOYSA-N
Synonyms

1(1adamantyl)~(N)((5chloro2((2fluorophenyl)methoxy)phenyl)methyl)ethanamine
1(1ADAMANTYL)N((5CHLORO2((2FLUOROPHENYL)METHOXY)PHENYL)METHYL)ETHANAMINE
4722551
InChI=1SC26H31ClFNOc117(261218819(1326)1020(918)1426)2915221123(27)6725(22)301621423524(21)28h2711172029H8101216H21H3
N(5chloro2((2fluorobenzyl)oxy)benzyl)1(tricyclo(3311~37~)dec1yl)ethanamine
ZINC000008497302
ZINC000008534854

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Available files

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