Vitas-M small molecule compound

7-(3-fluorobenzyl)-1,3-dimethyl-8-{[3-(propan-2-yloxy)propyl]amino}-3,7-dihydro-1H-purine-2,6-dione

Catalog ID
STL052833
SMILES CC(OCCCNc1nc2c(n1Cc1cccc(c1)F)c(=O)n(c(=O)n2C)C)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 C20H26FN5O3 MW 403.46 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H26FN5O3/c1-13(2)29-10-6-9-22-19-23-17-16(18(27)25(4)20(28)24(17)3)26(19)12-14-7-5-8-15(21)11-14/h5,7-8,11,13H,6,9-10,12H2,1-4H3,(H,22,23)
InChIKey
PZZRUTPKKCTSOG-UHFFFAOYSA-N
Synonyms
578000-41-6
578000416
7((3FLUOROPHENYL)METHYL)13DIMETHYL8(3PROPAN2YLOXYPROPYLAMINO)PURINE26DIONE
7(3FLUOROBENZYL)13DIMETHYL8((3(1METHYLETHOXY)PROPYL)AMINO)37DIHYDRO1HPURINE26DIONE
7(3fluorobenzyl)13dimethyl8((3(propan2yloxy)propyl)amino)37dihydro1Hpurine26dione
7(3fluorobenzyl)8((3isopropoxypropyl)amino)13dimethyl1Hpurine26(3H7H)dione
CC(C)OCCCNC1=NC2=C(N1CC3=CC(=CC=C3)F)C(=O)N(C(=O)N2C)C
InChI=1SC20H26FN5O3c113(2)2910692219231716(18(27)25(4)20(28)24(17)3)26(19)121475815(21)1114h5781113H691012H214H3(H2223)
MFCD04022820
ZINC000013748652
ZINC13748652

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Available files

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