Vitas-M small molecule compound

6-[4-(4-chlorobenzyl)piperazin-1-yl]-7H-purine

Catalog ID
STK660404
SMILES Clc1ccc(cc1)CN1CCN(CC1)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 C16H17ClN6 MW 328.80 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H17ClN6/c17-13-3-1-12(2-4-13)9-22-5-7-23(8-6-22)16-14-15(19-10-18-14)20-11-21-16/h1-4,10-11H,5-9H2,(H,18,19,20,21)
InChIKey
OQQXBRITKHELED-UHFFFAOYSA-N
Synonyms
1144470-85-8
1144470858
6(4((4chlorophenyl)methyl)piperazin1yl)7Hpurine
6(4(4chlorobenzyl)piperazin1yl)7Hpurine
6(4(4chlorobenzyl)piperazin1yl)9Hpurine
C1CN(CCN1CC2=CC=C(C=C2)Cl)C3=NC=NC4=C3NC=N4
Clc1ccc(cc1)CN1CCN(CC1)c1ncnc2c1(nH)cn2
Clc1ccc(cc1)CN1CCN(CC1)c1ncnc2c1nc(nH)2
InChI=1SC16H17ClN6c17133112(2413)9225723(8622)161415(19101814)20112116h141011H59H2(H18192021)
MFCD18169049
ZINC000096693166
ZINC96693166

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Available files

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