Vitas-M small molecule compound

1-(2-methylphenyl)-5-[2-(pyrrolidin-1-yl)tricyclo[3.3.1.1~3,7~]dec-2-yl]-1H-tetrazole

Catalog ID
STK507880
SMILES Cc1ccccc1n1nnnc1C1(C2CC3CC1CC(C2)C3)N1CCCC1

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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 C22H29N5 MW 363.51 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H29N5/c1-15-6-2-3-7-20(15)27-21(23-24-25-27)22(26-8-4-5-9-26)18-11-16-10-17(13-18)14-19(22)12-16/h2-3,6-7,16-19H,4-5,8-14H2,1H3
InChIKey
VOSIELWVKMVXJI-UHFFFAOYSA-N
Synonyms

1(2methylphenyl)5(2(pyrrolidin1yl)tricyclo(3311~37~)dec2yl)1Htetrazole
1(2methylphenyl)5(2pyrrolidin1yl2adamantyl)tetrazole
CC1=CC=CC=C1N2C(=NN=N2)C3(C4CC5CC(C4)CC3C5)N6CCCC6
InChI=1SC22H29N5c115623720(15)2721(23242527)22(26845926)1811161017(1318)1419(22)1216h23671619H45814H21H3
MFCD13369799
ZINC000035170750
ZINC35170750

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Available files

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