Vitas-M small molecule compound
7-(2-chloro-6-fluorobenzyl)-8-[(1-hydroxybutan-2-yl)amino]-1,3-dimethyl-3,7-dihydro-1H-purine-2,6-dione
Catalog ID
STK526122
SMILES CCC(Nc1nc2c(n1Cc1c(F)cccc1Cl)c(=O)n(c(=O)n2C)C)CO
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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 C18H21ClFN5O3 MW 409.85 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H21ClFN5O3/c1-4-10(9-26)21-17-22-15-14(16(27)24(3)18(28)23(15)2)25(17)8-11-12(19)6-5-7-13(11)20/h5-7,10,26H,4,8-9H2,1-3H3,(H,21,22)InChIKey
WOLYNRLRZMBZDU-UHFFFAOYSA-NSynonyms
305867-83-8305867838
7((2CHLORO6FLUOROPHENYL)METHYL)8(1HYDROXYBUTAN2YLAMINO)13DIMETHYLPURINE26DIONE
7(2chloro6fluorobenzyl)8((1hydroxybutan2yl)amino)13dimethyl1Hpurine26(3H7H)dione
7(2chloro6fluorobenzyl)8((1hydroxybutan2yl)amino)13dimethyl37dihydro1Hpurine26dione
CCC(CO)NC1=NC2=C(N1CC3=C(C=CC=C3Cl)F)C(=O)N(C(=O)N2C)C
InChI=1SC18H21ClFN5O3c1410(926)2117221514(16(27)24(3)18(28)23(15)2)25(17)81112(19)65713(11)20h571026H489H213H3(H2122)
MFCD01553987
ZINC000013512282
ZINC000013512285
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