Vitas-M small molecule compound
1-(2-chloro-6-fluorobenzyl)-3,7-dimethyl-8-[(pyridin-2-ylmethyl)amino]-3,7-dihydro-1H-purine-2,6-dione
Catalog ID
STK035184
SMILES Fc1cccc(c1Cn1c(=O)c2n(C)c(nc2n(c1=O)C)NCc1ccccn1)Cl
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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 C20H18ClFN6O2 MW 428.85 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H18ClFN6O2/c1-26-16-17(25-19(26)24-10-12-6-3-4-9-23-12)27(2)20(30)28(18(16)29)11-13-14(21)7-5-8-15(13)22/h3-9H,10-11H2,1-2H3,(H,24,25)InChIKey
FPXFRAFBAXBXRH-UHFFFAOYSA-NSynonyms
1((2CHLORO6FLUOROPHENYL)METHYL)37DIMETHYL8(PYRIDIN2YLMETHYLAMINO)PURINE26DIONE
1(2CHLORO6FLUOROBENZYL)37DIMETHYL8((PYRIDIN2YLMETHYL)AMINO)37DIHYDRO1HPURINE26DIONE
CN1C2=C(N=C1NCC3=CC=CC=N3)N(C(=O)N(C2=O)CC4=C(C=CC=C4Cl)F)C
Fc1cccc(c1Cn1c(=O)c2n(C)c(nc2n(c1=O)C)NCc1ccccn1)Cl
InChI=1SC20H18ClFN6O2c1261617(2519(26)24101263492312)27(2)20(30)28(18(16)29)111314(21)75815(13)22h39H1011H212H3(H2425)
MFCD08050438
STK035184
ZINC000009246238
ZINC09246238
ZINC9246238
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