Vitas-M small molecule compound
2-[1-(2,3-dihydro-1,4-benzodioxin-6-yl)-1H-tetrazol-5-yl]-N-(4-methoxyphenyl)tricyclo[3.3.1.1~3,7~]decan-2-amine
Catalog ID
STK507405
SMILES COc1ccc(cc1)NC1(C2CC3CC1CC(C2)C3)c1nnnn1c1ccc2c(c1)OCCO2
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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 C26H29N5O3 MW 459.55 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H29N5O3/c1-32-22-5-2-20(3-6-22)27-26(18-11-16-10-17(13-18)14-19(26)12-16)25-28-29-30-31(25)21-4-7-23-24(15-21)34-9-8-33-23/h2-7,15-19,27H,8-14H2,1H3InChIKey
BCSFUQPOJCDUNH-UHFFFAOYSA-NSynonyms
2(1(23dihydro14benzodioxin6yl)1Htetrazol5yl)N(4methoxyphenyl)tricyclo(3311~37~)decan2amine
2(1(23dihydro14benzodioxin6yl)tetrazol5yl)N(4methoxyphenyl)adamantan2amine
COC1=CC=C(C=C1)NC2(C3CC4CC(C3)CC2C4)C5=NN=NN5C6=CC7=C(C=C6)OCCO7
InChI=1SC26H29N5O3c132225220(3622)2726(1811161017(1318)1419(26)1216)2528293031(25)21472324(1521)34983323h27151927H814H21H3
MFCD13369336
ZINC000035170761
ZINC35170761
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