Vitas-M small molecule compound

7-[2-hydroxy-3-(4-methoxyphenoxy)propyl]-1,3-dimethyl-8-[(3-methylphenyl)amino]-3,7-dihydro-1H-purine-2,6-dione

Catalog ID
STK845150
SMILES COc1ccc(cc1)OCC(Cn1c(Nc2cccc(c2)C)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 C24H27N5O5 MW 465.51 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H27N5O5/c1-15-6-5-7-16(12-15)25-23-26-21-20(22(31)28(3)24(32)27(21)2)29(23)13-17(30)14-34-19-10-8-18(33-4)9-11-19/h5-12,17,30H,13-14H2,1-4H3,(H,25,26)
InChIKey
LVUWOYOPMGLSJX-UHFFFAOYSA-N
Synonyms
536718-93-1
536718931
7(2hydroxy3(4methoxyphenoxy)propyl)13dimethyl8((3methylphenyl)amino)37dihydro1Hpurine26dione
7(2HYDROXY3(4METHOXYPHENOXY)PROPYL)13DIMETHYL8(3METHYLANILINO)PURINE26DIONE
7(2hydroxy3(4methoxyphenoxy)propyl)13dimethyl8(mtolylamino)1Hpurine26(3H7H)dione
CC1=CC(=CC=C1)NC2=NC3=C(N2CC(COC4=CC=C(C=C4)OC)O)C(=O)N(C(=O)N3C)C
InChI=1SC24H27N5O5c11565716(1215)2523262120(22(31)28(3)24(32)27(21)2)29(23)1317(30)14341910818(334)91119h5121730H1314H214H3(H2526)
MFCD04014638
ZINC000002421966
ZINC000002421967

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Available files

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