Vitas-M small molecule compound
3-methyl-7-(3-methylbenzyl)-8-(piperazin-1-yl)-3,7-dihydro-1H-purine-2,6-dione
Catalog ID
STK526960
SMILES Cc1cccc(c1)Cn1c(nc2c1c(=O)[nH]c(=O)n2C)N1CCNCC1
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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 C18H22N6O2 MW 354.41 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H22N6O2/c1-12-4-3-5-13(10-12)11-24-14-15(22(2)18(26)21-16(14)25)20-17(24)23-8-6-19-7-9-23/h3-5,10,19H,6-9,11H2,1-2H3,(H,21,25,26)InChIKey
NCBQWTNHQFIYCS-UHFFFAOYSA-NSynonyms
303973-23-1303973231
3METHYL7((3METHYLPHENYL)METHYL)8PIPERAZIN1YLPURINE26DIONE
3METHYL7((3METHYLPHENYL)METHYL)8PIPERAZINYL137TRIHYDROPURINE26DIONE
3methyl7(3methylbenzyl)8(piperazin1yl)1Hpurine26(3H7H)dione
3methyl7(3methylbenzyl)8(piperazin1yl)37dihydro1Hpurine26dione
3METHYL7(3METHYLBENZYL)8PIPERAZIN1YL37DIHYDROPURINE26DIONE
CC1=CC(=CC=C1)CN2C3=C(N=C2N4CCNCC4)N(C(=O)NC3=O)C
Cc1cccc(c1)Cn1c(nc2c1c(=O)(nH)c(=O)n2C)N1CCNCC1
InChI=1SC18H22N6O2c11243513(1012)11241415(22(2)18(26)2116(14)25)2017(24)2386197923h351019H6911H212H3(H212526)
MFCD01186418
ZINC000004730519
ZINC4730519
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