Vitas-M small molecule compound

7-(4-chlorobenzyl)-1,3-dimethyl-8-(4-phenylpiperazin-1-yl)-3,7-dihydro-1H-purine-2,6-dione

Catalog ID
STK262563
SMILES Clc1ccc(cc1)Cn1c(nc2c1c(=O)n(c(=O)n2C)C)N1CCN(CC1)c1ccccc1

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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 C24H25ClN6O2 MW 464.95 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H25ClN6O2/c1-27-21-20(22(32)28(2)24(27)33)31(16-17-8-10-18(25)11-9-17)23(26-21)30-14-12-29(13-15-30)19-6-4-3-5-7-19/h3-11H,12-16H2,1-2H3
InChIKey
OTIGHKYHGAEMFU-UHFFFAOYSA-N
Synonyms

7((4chlorophenyl)methyl)13dimethyl8(4phenylpiperazin1yl)purine26dione
7((4CHLOROPHENYL)METHYL)13DIMETHYL8(4PHENYLPIPERAZINYL)137TRIHYDROPURINE26DIONE
7(4chlorobenzyl)13dimethyl8(4phenylpiperazin1yl)37dihydro1Hpurine26dione
CN1C2=C(C(=O)N(C1=O)C)N(C(=N2)N3CCN(CC3)C4=CC=CC=C4)CC5=CC=C(C=C5)Cl
InChI=1SC24H25ClN6O2c1272120(22(32)28(2)24(27)33)31(161781018(25)11917)23(2621)30141229(131530)196435719h311H1216H212H3
MFCD07037238
ZINC000008775106
ZINC08775106
ZINC8775106

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Available files

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