Vitas-M small molecule compound

2-({2-[(3-chlorophenyl)amino]-7H-purin-6-yl}amino)ethanol

Catalog ID
STK658479
SMILES OCCNc1nc(Nc2cccc(c2)Cl)nc2c1[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 C13H13ClN6O MW 304.74 g/mol Purity >90% as per NMR
InChI
InChI=1S/C13H13ClN6O/c14-8-2-1-3-9(6-8)18-13-19-11(15-4-5-21)10-12(20-13)17-7-16-10/h1-3,6-7,21H,4-5H2,(H3,15,16,17,18,19,20)
InChIKey
BOEDCSPQJSVMRO-UHFFFAOYSA-N
Synonyms
1144471-34-0
1144471340
2((2((3chlorophenyl)amino)7Hpurin6yl)amino)ethanol
2((2((3chlorophenyl)amino)9Hpurin6yl)amino)ethanol
2((2(3chloroanilino)7Hpurin6yl)amino)ethanol
C1=CC(=CC(=C1)Cl)NC2=NC3=C(C(=N2)NCCO)NC=N3
InChI=1SC13H13ClN6Oc1482139(68)18131911(154521)1012(2013)1771610h136721H45H2(H3151617181920)
MFCD18168392
OCCNc1nc(Nc2cccc(c2)Cl)nc2c1(nH)cn2
OCCNc1nc(Nc2cccc(c2)Cl)nc2c1nc(nH)2
ZINC000032105446
ZINC32105446

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Available files

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