Vitas-M small molecule compound
N-(1,3-benzodioxol-5-yl)-1-(9H-purin-6-yl)piperidine-3-carboxamide
Catalog ID
STK612550
SMILES O=C(C1CCCN(C1)c1ncnc2c1nc[nH]2)Nc1ccc2c(c1)OCO2
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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 C18H18N6O3 MW 366.38 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H18N6O3/c25-18(23-12-3-4-13-14(6-12)27-10-26-13)11-2-1-5-24(7-11)17-15-16(20-8-19-15)21-9-22-17/h3-4,6,8-9,11H,1-2,5,7,10H2,(H,23,25)(H,19,20,21,22)InChIKey
LLIZDVNNWZNYDW-UHFFFAOYSA-NSynonyms
920431-88-5920431885
C1CC(CN(C1)C2=NC=NC3=C2NC=N3)C(=O)NC4=CC5=C(C=C4)OCO5
InChI=1SC18H18N6O3c2518(2312341314(612)27102613)1121524(711)171516(2081915)2192217h3468911H125710H2(H2325)(H19202122)
MFCD08749691
N(13benzodioxol5yl)1(7Hpurin6yl)piperidine3carboxamide
N(13benzodioxol5yl)1(9Hpurin6yl)piperidine3carboxamide
N(benzo(d)(13)dioxol5yl)1(9Hpurin6yl)piperidine3carboxamide
O=C(C1CCCN(C1)c1ncnc2c1nc(nH)2)Nc1ccc2c(c1)OCO2
ZINC000009418497
ZINC000009418498
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