Vitas-M small molecule compound
methyl (8-{[4-(5-chloro-2-methylphenyl)piperazin-1-yl]methyl}-1,3-dimethyl-2,6-dioxo-1,2,3,6-tetrahydro-7H-purin-7-yl)acetate
Catalog ID
STK583457
SMILES COC(=O)Cn1c(CN2CCN(CC2)c2cc(Cl)ccc2C)nc2c1c(=O)n(c(=O)n2C)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 C22H27ClN6O4 MW 474.95 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H27ClN6O4/c1-14-5-6-15(23)11-16(14)28-9-7-27(8-10-28)12-17-24-20-19(29(17)13-18(30)33-4)21(31)26(3)22(32)25(20)2/h5-6,11H,7-10,12-13H2,1-4H3InChIKey
QCMFRDLWDABJEH-UHFFFAOYSA-NSynonyms
893946-18-4893946184
CC1=C(C=C(C=C1)Cl)N2CCN(CC2)CC3=NC4=C(N3CC(=O)OC)C(=O)N(C(=O)N4C)C
InChI=1SC22H27ClN6O4c1145615(23)1116(14)289727(81028)1217242019(29(17)1318(30)334)21(31)26(3)22(32)25(20)2h5611H7101213H214H3
methyl(8((4(5chloro2methylphenyl)piperazin1yl)methyl)13dimethyl26dioxo1236tetrahydro7Hpurin7yl)acetate
methyl2(8((4(5chloro2methylphenyl)piperazin1yl)methyl)13dimethyl26dioxo23dihydro1Hpurin7(6H)yl)acetate
METHYL2(8((4(5CHLORO2METHYLPHENYL)PIPERAZIN1YL)METHYL)13DIMETHYL26DIOXOPURIN7YL)ACETATE
METHYL2(8((4(5CHLORO2METHYLPHENYL)PIPERAZINYL)METHYL)13DIMETHYL26DIOXO137TRIHYDROPURIN7YL)ACETATE
MFCD06605665
ZINC000057110893
ZINC57110893
Check stock
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