Vitas-M small molecule compound
8-{[4-(4-fluorophenyl)piperazin-1-yl]methyl}-1,3-dimethyl-7-(3-methylbenzyl)-3,7-dihydro-1H-purine-2,6-dione
Catalog ID
STK582141
SMILES Fc1ccc(cc1)N1CCN(CC1)Cc1nc2c(n1Cc1cccc(c1)C)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 C26H29FN6O2 MW 476.55 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H29FN6O2/c1-18-5-4-6-19(15-18)16-33-22(28-24-23(33)25(34)30(3)26(35)29(24)2)17-31-11-13-32(14-12-31)21-9-7-20(27)8-10-21/h4-10,15H,11-14,16-17H2,1-3H3InChIKey
LFRZLDODGMGTPG-UHFFFAOYSA-NSynonyms
851938-83-58((4(4FLUOROPHENYL)PIPERAZIN1YL)METHYL)13DIMETHYL7((3METHYLPHENYL)METHYL)PURINE26DIONE
8((4(4fluorophenyl)piperazin1yl)methyl)13dimethyl7(3methylbenzyl)1Hpurine26(3H7H)dione
8((4(4fluorophenyl)piperazin1yl)methyl)13dimethyl7(3methylbenzyl)37dihydro1Hpurine26dione
851938835
CC1=CC(=CC=C1)CN2C(=NC3=C2C(=O)N(C(=O)N3C)C)CN4CCN(CC4)C5=CC=C(C=C5)F
InChI=1SC26H29FN6O2c11854619(1518)163322(282423(33)25(34)30(3)26(35)29(24)2)1731111332(141231)219720(27)81021h41015H11141617H213H3
MFCD04466382
ZINC000057110743
ZINC57110743
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