Vitas-M small molecule compound
1-(3-chlorobenzyl)-3,7-dimethyl-3,7-dihydro-1H-purine-2,6-dione
Catalog ID
STL383292
SMILES Clc1cccc(c1)Cn1c(=O)c2n(C)cnc2n(c1=O)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 C14H13ClN4O2 MW 304.74 g/mol Purity >90% as per NMR
InChI
InChI=1S/C14H13ClN4O2/c1-17-8-16-12-11(17)13(20)19(14(21)18(12)2)7-9-4-3-5-10(15)6-9/h3-6,8H,7H2,1-2H3InChIKey
NYPJPHKZCUHYOG-UHFFFAOYSA-NSynonyms
1((3CHLOROPHENYL)METHYL)37DIMETHYLPURINE26DIONE
1(3chlorobenzyl)37dimethyl37dihydro1Hpurine26dione
CN1C=NC2=C1C(=O)N(C(=O)N2C)CC3=CC(=CC=C3)Cl
InChI=1SC14H13ClN4O2c1178161211(17)13(20)19(14(21)18(12)2)7943510(15)69h368H7H212H3
MFCD02637353
ZINC000000093675
ZINC00093675
ZINC93675
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