Vitas-M small molecule compound
8-{[benzyl(methyl)amino]methyl}-7-(2-chloro-6-fluorobenzyl)-1,3-dimethyl-3,7-dihydro-1H-purine-2,6-dione
Catalog ID
STL003112
SMILES CN(Cc1nc2c(n1Cc1c(F)cccc1Cl)c(=O)n(c(=O)n2C)C)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 C23H23ClFN5O2 MW 455.92 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H23ClFN5O2/c1-27(12-15-8-5-4-6-9-15)14-19-26-21-20(22(31)29(3)23(32)28(21)2)30(19)13-16-17(24)10-7-11-18(16)25/h4-11H,12-14H2,1-3H3InChIKey
LWMUHXPRRJCEGV-UHFFFAOYSA-NSynonyms
841211-41-47((2CHLORO6FLUOROPHENYL)METHYL)13DIMETHYL8((METHYLBENZYLAMINO)METHYL)137TRIHYDROPURINE26DIONE
8((BENZYL(METHYL)AMINO)METHYL)7((2CHLORO6FLUOROPHENYL)METHYL)13DIMETHYLPURINE26DIONE
8((benzyl(methyl)amino)methyl)7(2chloro6fluorobenzyl)13dimethyl1Hpurine26(3H7H)dione
8((benzyl(methyl)amino)methyl)7(2chloro6fluorobenzyl)13dimethyl37dihydro1Hpurine26dione
841211414
CN1C2=C(C(=O)N(C1=O)C)N(C(=N2)CN(C)CC3=CC=CC=C3)CC4=C(C=CC=C4Cl)F
InChI=1SC23H23ClFN5O2c127(12158546915)1419262120(22(31)29(3)23(32)28(21)2)30(19)131617(24)1071118(16)25h411H1214H213H3
MFCD04012044
ZINC000008725382
ZINC8725382
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