Vitas-M small molecule compound

N-{3-methoxy-4-[(1-phenyl-1H-tetrazol-5-yl)oxy]benzyl}cycloheptanamine

Catalog ID
STK511803
SMILES COc1cc(CNC2CCCCCC2)ccc1Oc1nnnn1c1ccccc1

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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 C22H27N5O2 MW 393.49 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H27N5O2/c1-28-21-15-17(16-23-18-9-5-2-3-6-10-18)13-14-20(21)29-22-24-25-26-27(22)19-11-7-4-8-12-19/h4,7-8,11-15,18,23H,2-3,5-6,9-10,16H2,1H3
InChIKey
NNXPWDCAYGXNJJ-UHFFFAOYSA-N
Synonyms

COC1=C(C=CC(=C1)CNC2CCCCCC2)OC3=NN=NN3C4=CC=CC=C4
InChI=1SC22H27N5O2c128211517(162318952361018)131420(21)292224252627(22)19117481219h47811151823H235691016H21H3
MFCD09688366
N((3methoxy4(1phenyltetrazol5yl)oxyphenyl)methyl)cycloheptanamine
N(3methoxy4((1phenyl1Htetrazol5yl)oxy)benzyl)cycloheptanamine
ZINC000013717761
ZINC13717761

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Available files

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