Vitas-M small molecule compound
(3,4-dimethoxyphenyl)[4-(9H-purin-6-yl)piperazin-1-yl]methanone
Catalog ID
STK719168
SMILES COc1cc(ccc1OC)C(=O)N1CCN(CC1)c1ncnc2c1nc[nH]2
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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 C18H20N6O3 MW 368.40 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H20N6O3/c1-26-13-4-3-12(9-14(13)27-2)18(25)24-7-5-23(6-8-24)17-15-16(20-10-19-15)21-11-22-17/h3-4,9-11H,5-8H2,1-2H3,(H,19,20,21,22)InChIKey
HAVLUOWPOKFCRX-UHFFFAOYSA-NSynonyms
1010874-00-6(34dimethoxyphenyl)(4(7Hpurin6yl)piperazin1yl)methanone
(34dimethoxyphenyl)(4(9Hpurin6yl)piperazin1yl)methanone
(4(9Hpurin6yl)piperazin1yl)(34dimethoxyphenyl)methanone
1010874006
COC1=C(C=C(C=C1)C(=O)N2CCN(CC2)C3=NC=NC4=C3NC=N4)OC
COc1cc(ccc1OC)C(=O)N1CCN(CC1)c1ncnc2c1nc(nH)2
InChI=1SC18H20N6O3c126134312(914(13)272)18(25)247523(6824)171516(20101915)21112217h34911H58H212H3(H19202122)
MFCD12203583
ZINC000012323910
ZINC12323910
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