Vitas-M small molecule compound
N-(4-fluorophenyl)-2-[4-(2-methoxyphenyl)piperazin-1-yl]-9H-purin-6-amine
Catalog ID
STL011559
SMILES COc1ccccc1N1CCN(CC1)c1nc(Nc2ccc(cc2)F)c2c(n1)[nH]cn2
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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 C22H22FN7O MW 419.46 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H22FN7O/c1-31-18-5-3-2-4-17(18)29-10-12-30(13-11-29)22-27-20-19(24-14-25-20)21(28-22)26-16-8-6-15(23)7-9-16/h2-9,14H,10-13H2,1H3,(H2,24,25,26,27,28)InChIKey
HLXHHMNCTAUERA-UHFFFAOYSA-NSynonyms
COC1=CC=CC=C1N2CCN(CC2)C3=NC4=C(C(=N3)NC5=CC=C(C=C5)F)NC=N4
COc1ccccc1N1CCN(CC1)c1nc(Nc2ccc(cc2)F)c2c(n1)(nH)cn2
InChI=1SC22H22FN7Oc13118532417(18)29101230(131129)22272019(24142520)21(2822)26168615(23)7916h2914H1013H21H3(H22425262728)
MFCD18185453
N(4fluorophenyl)2(4(2methoxyphenyl)piperazin1yl)7Hpurin6amine
N(4fluorophenyl)2(4(2methoxyphenyl)piperazin1yl)9Hpurin6amine
ZINC000051353934
ZINC51353934
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