Vitas-M small molecule compound
8-[4-(3-chlorophenyl)piperazin-1-yl]-1,3-dimethyl-7-(3-methylbutyl)-3,7-dihydro-1H-purine-2,6-dione
Catalog ID
STK844953
SMILES CC(CCn1c(nc2c1c(=O)n(c(=O)n2C)C)N1CCN(CC1)c1cccc(c1)Cl)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 C22H29ClN6O2 MW 444.96 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H29ClN6O2/c1-15(2)8-9-29-18-19(25(3)22(31)26(4)20(18)30)24-21(29)28-12-10-27(11-13-28)17-7-5-6-16(23)14-17/h5-7,14-15H,8-13H2,1-4H3InChIKey
DQRFHFUMLKYNCW-UHFFFAOYSA-NSynonyms
840485-98-58(4(3chlorophenyl)piperazin1yl)13dimethyl7(3methylbutyl)37dihydro1Hpurine26dione
8(4(3CHLOROPHENYL)PIPERAZIN1YL)13DIMETHYL7(3METHYLBUTYL)PURINE26DIONE
8(4(3chlorophenyl)piperazin1yl)7isopentyl13dimethyl1Hpurine26(3H7H)dione
8(4(3CHLOROPHENYL)PIPERAZINYL)13DIMETHYL7(3METHYLBUTYL)137TRIHYDROPURINE26DIONE
840485985
CC(C)CCN1C2=C(N=C1N3CCN(CC3)C4=CC(=CC=C4)Cl)N(C(=O)N(C2=O)C)C
InChI=1SC22H29ClN6O2c115(2)89291819(25(3)22(31)26(4)20(18)30)2421(29)28121027(111328)1775616(23)1417h571415H813H214H3
MFCD04007713
ZINC000009463556
ZINC09463556
ZINC9463556
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