Vitas-M small molecule compound
7-[2-hydroxy-3-(4-methoxyphenoxy)propyl]-1,3-dimethyl-8-(methylamino)-3,7-dihydro-1H-purine-2,6-dione
Catalog ID
STK840667
SMILES COc1ccc(cc1)OCC(Cn1c(NC)nc2c1c(=O)n(C)c(=O)n2C)O
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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 C18H23N5O5 MW 389.41 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H23N5O5/c1-19-17-20-15-14(16(25)22(3)18(26)21(15)2)23(17)9-11(24)10-28-13-7-5-12(27-4)6-8-13/h5-8,11,24H,9-10H2,1-4H3,(H,19,20)InChIKey
ZTCUJMYSHLACFH-UHFFFAOYSA-NSynonyms
7(2HYDROXY3(4METHOXYPHENOXY)PROPYL)13DIMETHYL8(METHYLAMINO)1HPURINE26(3H7H)DIONE
7(2hydroxy3(4methoxyphenoxy)propyl)13dimethyl8(methylamino)37dihydro1Hpurine26dione
7(2HYDROXY3(4METHOXYPHENOXY)PROPYL)13DIMETHYL8(METHYLAMINO)PURINE26DIONE
CNC1=NC2=C(N1CC(COC3=CC=C(C=C3)OC)O)C(=O)N(C(=O)N2C)C
InChI=1SC18H23N5O5c11917201514(16(25)22(3)18(26)21(15)2)23(17)911(24)1028137512(274)6813h581124H910H214H3(H1920)
MFCD02579151
ZINC000000629988
ZINC000000629991
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