Vitas-M small molecule compound
N-[2-(3,4-dimethoxyphenyl)ethyl]-1-(7H-purin-6-yl)piperidine-3-carboxamide
Catalog ID
STK617864
SMILES COc1cc(CCNC(=O)C2CCCN(C2)c2ncnc3c2[nH]cn3)ccc1OC
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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 C21H26N6O3 MW 410.48 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H26N6O3/c1-29-16-6-5-14(10-17(16)30-2)7-8-22-21(28)15-4-3-9-27(11-15)20-18-19(24-12-23-18)25-13-26-20/h5-6,10,12-13,15H,3-4,7-9,11H2,1-2H3,(H,22,28)(H,23,24,25,26)InChIKey
KXDIOVHPJVWOBL-UHFFFAOYSA-NSynonyms
920471-41-6920471416
COC1=C(C=C(C=C1)CCNC(=O)C2CCCN(C2)C3=NC=NC4=C3NC=N4)OC
COc1cc(CCNC(=O)C2CCCN(C2)c2ncnc3c2(nH)cn3)ccc1OC
COc1cc(CCNC(=O)C2CCCN(C2)c2ncnc3c2nc(nH)3)ccc1OC
InChI=1SC21H26N6O3c129166514(1017(16)302)782221(28)1543927(1115)201819(24122318)25132620h5610121315H347911H212H3(H2228)(H23242526)
MFCD09790296
N(2(34dimethoxyphenyl)ethyl)1(7Hpurin6yl)piperidine3carboxamide
N(34dimethoxyphenethyl)1(9Hpurin6yl)piperidine3carboxamide
ZINC000009060525
ZINC000009060526
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