Vitas-M small molecule compound

8-[(4-benzylpiperazin-1-yl)methyl]-1,3-dimethyl-7-(2-phenylethyl)-3,7-dihydro-1H-purine-2,6-dione

Catalog ID
STL003180
SMILES Cn1c(=O)n(C)c(=O)c2c1nc(n2CCc1ccccc1)CN1CCN(CC1)Cc1ccccc1

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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(14-13-21-9-5-3-6-10-21)23(28-25)20-32-17-15-31(16-18-32)19-22-11-7-4-8-12-22/h3-12H,13-20H2,1-2H3
InChIKey
CSQUSVMYYLBCEA-UHFFFAOYSA-N
Synonyms
573942-01-5
13DIMETHYL7(2PHENYLETHYL)8((4BENZYLPIPERAZINYL)METHYL)137TRIHYDROPURINE26DIONE
573942015
8((4benzylpiperazin1yl)methyl)13dimethyl7(2phenylethyl)37dihydro1Hpurine26dione
8((4benzylpiperazin1yl)methyl)13dimethyl7(2phenylethyl)purine26dione
8((4benzylpiperazin1yl)methyl)13dimethyl7phenethyl1Hpurine26(3H7H)dione
8((4BENZYLPIPERAZIN1YL)METHYL)13DIMETHYL7PHENETHYLPURINE26DIONE
CN1C2=C(C(=O)N(C1=O)C)N(C(=N2)CN3CCN(CC3)CC4=CC=CC=C4)CCC5=CC=CC=C5
InChI=1SC27H32N6O2c1292524(26(34)30(2)27(29)35)33(14132195361021)23(2825)2032171531(161832)1922117481222h312H1320H212H3
MFCD04020572
ZINC000020292002
ZINC20292002

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Available files

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