Vitas-M small molecule compound
1,3-dimethyl-8-[(4-phenylpiperazin-1-yl)methyl]-7-(3-phenylpropyl)-3,7-dihydro-1H-purine-2,6-dione
Catalog ID
STK581741
SMILES O=c1n(C)c2nc(n(c2c(=O)n1C)CCCc1ccccc1)CN1CCN(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 C27H32N6O2 MW 472.59 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H32N6O2/c1-29-25-24(26(34)30(2)27(29)35)33(15-9-12-21-10-5-3-6-11-21)23(28-25)20-31-16-18-32(19-17-31)22-13-7-4-8-14-22/h3-8,10-11,13-14H,9,12,15-20H2,1-2H3InChIKey
HLFBKRVBTHWJPL-UHFFFAOYSA-NSynonyms
838896-05-213dimethyl8((4phenylpiperazin1yl)methyl)7(3phenylpropyl)1Hpurine26(3H7H)dione
13dimethyl8((4phenylpiperazin1yl)methyl)7(3phenylpropyl)37dihydro1Hpurine26dione
13DIMETHYL8((4PHENYLPIPERAZIN1YL)METHYL)7(3PHENYLPROPYL)PURINE26DIONE
13DIMETHYL8((4PHENYLPIPERAZINYL)METHYL)7(3PHENYLPROPYL)137TRIHYDROPURINE26DIONE
838896052
CN1C2=C(C(=O)N(C1=O)C)N(C(=N2)CN3CCN(CC3)C4=CC=CC=C4)CCCC5=CC=CC=C5
InChI=1SC27H32N6O2c1292524(26(34)30(2)27(29)35)33(1591221105361121)23(2825)2031161832(191731)22137481422h3810111314H9121520H212H3
MFCD04466734
ZINC000055558806
ZINC55558806
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