Vitas-M small molecule compound

3-benzyl-6-hydroxy-3,7-dihydro-2H-purin-2-one

Catalog ID
STK594792
SMILES Oc1nc(=O)n(c2c1[nH]cn2)Cc1ccccc1

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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 C12H10N4O2 MW 242.24 g/mol Purity >90% as per NMR
InChI
InChI=1S/C12H10N4O2/c17-11-9-10(14-7-13-9)16(12(18)15-11)6-8-4-2-1-3-5-8/h1-5,7H,6H2,(H,13,14)(H,15,17,18)
InChIKey
YWCSDTAKJJLSPO-UHFFFAOYSA-N
Synonyms
19844-93-0
19844930
3BENZYL1HPURINE26(3H7H)DIONE
3BENZYL2HYDROXY19DIHYDROPURIN6ONE
3BENZYL2HYDROXY9HPURIN6(3H)ONE
3BENZYL37DIHYDRO1HPURINE26DIONE
3benzyl6hydroxy37dihydro2Hpurin2one
3BENZYL7HPURINE26DIONE
C1=CC=C(C=C1)CN2C3=C(C(=O)NC2=O)NC=N3
InChI=1SC12H10N4O2c1711910(147139)16(12(18)1511)68421358h157H6H2(H1314)(H151718)
MFCD07201529
Oc1nc(=O)n(c2c1(nH)cn2)Cc1ccccc1
ZINC000015916335
ZINC15916335

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Available files

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