Vitas-M small molecule compound
methyl {8-[(4-benzylpiperazin-1-yl)methyl]-1,3-dimethyl-2,6-dioxo-1,2,3,6-tetrahydro-7H-purin-7-yl}acetate
Catalog ID
STL002031
SMILES COC(=O)Cn1c(CN2CCN(CC2)Cc2ccccc2)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 C22H28N6O4 MW 440.50 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H28N6O4/c1-24-20-19(21(30)25(2)22(24)31)28(15-18(29)32-3)17(23-20)14-27-11-9-26(10-12-27)13-16-7-5-4-6-8-16/h4-8H,9-15H2,1-3H3InChIKey
MZSXPZMPSRBHMI-UHFFFAOYSA-NSynonyms
578762-37-5578762375
CN1C2=C(C(=O)N(C1=O)C)N(C(=N2)CN3CCN(CC3)CC4=CC=CC=C4)CC(=O)OC
InChI=1SC22H28N6O4c1242019(21(30)25(2)22(24)31)28(1518(29)323)17(2320)142711926(101227)13167546816h48H915H213H3
methyl(8((4benzylpiperazin1yl)methyl)13dimethyl26dioxo1236tetrahydro7Hpurin7yl)acetate
METHYL2(13DIMETHYL26DIOXO8((4BENZYLPIPERAZINYL)METHYL)137TRIHYDROPURIN7YL)ACETATE
methyl2(8((4benzylpiperazin1yl)methyl)13dimethyl26dioxo23dihydro1Hpurin7(6H)yl)acetate
METHYL2(8((4BENZYLPIPERAZIN1YL)METHYL)13DIMETHYL26DIOXOPURIN7YL)ACETATE
MFCD04025863
ZINC000020326400
ZINC20326400
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