Vitas-M small molecule compound
7-(3-chlorobenzyl)-8-{[4-(4-methoxyphenyl)piperazin-1-yl]methyl}-1,3-dimethyl-3,7-dihydro-1H-purine-2,6-dione
Catalog ID
STK578242
SMILES COc1ccc(cc1)N1CCN(CC1)Cc1nc2c(n1Cc1cccc(c1)Cl)c(=O)n(c(=O)n2C)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 C26H29ClN6O3 MW 509.01 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H29ClN6O3/c1-29-24-23(25(34)30(2)26(29)35)33(16-18-5-4-6-19(27)15-18)22(28-24)17-31-11-13-32(14-12-31)20-7-9-21(36-3)10-8-20/h4-10,15H,11-14,16-17H2,1-3H3InChIKey
DNVIASQCOBUSPT-UHFFFAOYSA-NSynonyms
851940-12-07((3CHLOROPHENYL)METHYL)8((4(4METHOXYPHENYL)PIPERAZIN1YL)METHYL)13DIMETHYLPURINE26DIONE
7((3CHLOROPHENYL)METHYL)8((4(4METHOXYPHENYL)PIPERAZINYL)METHYL)13DIMETHYL137TRIHYDROPURINE26DIONE
7(3CHLOROBENZYL)8((4(4METHOXYPHENYL)PIPERAZIN1YL)METHYL)13DIMETHYL1HPURINE26(3H7H)DIONE
7(3chlorobenzyl)8((4(4methoxyphenyl)piperazin1yl)methyl)13dimethyl37dihydro1Hpurine26dione
851940120
CN1C2=C(C(=O)N(C1=O)C)N(C(=N2)CN3CCN(CC3)C4=CC=C(C=C4)OC)CC5=CC(=CC=C5)Cl
InChI=1SC26H29ClN6O3c1292423(25(34)30(2)26(29)35)33(161854619(27)1518)22(2824)1731111332(141231)207921(363)10820h41015H11141617H213H3
MFCD04466486
ZINC000057010913
ZINC57010913
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