Vitas-M small molecule compound

7-(3-chlorobenzyl)-8-(3,5-dimethyl-1H-pyrazol-1-yl)-6-hydroxy-3-methyl-3,7-dihydro-2H-purin-2-one

Catalog ID
STK928747
SMILES Clc1cccc(c1)Cn1c(nc2c1c(O)nc(=O)n2C)n1nc(cc1C)C

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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 C18H17ClN6O2 MW 384.82 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H17ClN6O2/c1-10-7-11(2)25(22-10)17-20-15-14(16(26)21-18(27)23(15)3)24(17)9-12-5-4-6-13(19)8-12/h4-8H,9H2,1-3H3,(H,21,26,27)
InChIKey
PZCOVLKSQJJSKM-UHFFFAOYSA-N
Synonyms
1014072-99-1
1014072991
7((3chlorophenyl)methyl)8(35dimethylpyrazol1yl)3methylpurine26dione
7(3CHLOROBENZYL)8(35DIMETHYL1HPYRAZOL1YL)3METHYL1HPURINE26(3H7H)DIONE
7(3chlorobenzyl)8(35dimethyl1Hpyrazol1yl)6hydroxy3methyl37dihydro2Hpurin2one
8(35DIMETHYLPYRAZOLYL)7((3CHLOROPHENYL)METHYL)3METHYL137TRIHYDROPURINE26DIONE
CC1=CC(=NN1C2=NC3=C(N2CC4=CC(=CC=C4)Cl)C(=O)NC(=O)N3C)C
InChI=1SC18H17ClN6O2c110711(2)25(2210)17201514(16(26)2118(27)23(15)3)24(17)91254613(19)812h48H9H213H3(H212627)
MFCD18176184
ZINC000012231322
ZINC12231322

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Available files

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