Vitas-M small molecule compound

ethyl 1-(7H-purin-6-yl)piperidine-3-carboxylate

Catalog ID
STK855993
SMILES CCOC(=O)C1CCCN(C1)c1ncnc2c1[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 C13H17N5O2 MW 275.31 g/mol Purity >90% as per NMR
InChI
InChI=1S/C13H17N5O2/c1-2-20-13(19)9-4-3-5-18(6-9)12-10-11(15-7-14-10)16-8-17-12/h7-9H,2-6H2,1H3,(H,14,15,16,17)
InChIKey
IVIROJAYYZROIX-UHFFFAOYSA-N
Synonyms
537667-09-7
1(9HPURINE6YL)PIPERIDINE3CARBOXYLICACIDETHYLESTER
537667097
CCOC(=O)C1CCCN(C1)c1ncnc2c1(nH)cn2
CCOC(=O)C1CCCN(C1)c1ncnc2c1nc(nH)2
CCOC(=O)C1CCCN(C1)C2=NC=NC3=C2NC=N3
ETHYL(3R)1(7HPURIN6YL)PIPERIDINE3CARBOXYLATE
ethyl1(7Hpurin6yl)piperidine3carboxylate
ethyl1(9Hpurin6yl)piperidine3carboxylate
ETHYL1PURIN6YLPIPERIDINE3CARBOXYLATE
InChI=1SC13H17N5O2c122013(19)943518(69)121011(1571410)1681712h79H26H21H3(H14151617)
MFCD09789406
ZINC000004032444
ZINC000004032445

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.