Vitas-M small molecule compound

9-(4-methoxyphenyl)-1,7-dimethyl-3-pentyl-6,7,8,9-tetrahydropyrimido[2,1-f]purine-2,4(1H,3H)-dione

Catalog ID
STL342759
SMILES CCCCCn1c(=O)n(C)c2c(c1=O)n1CC(C)CN(c1n2)c1ccc(cc1)OC

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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 C22H29N5O3 MW 411.50 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H29N5O3/c1-5-6-7-12-25-20(28)18-19(24(3)22(25)29)23-21-26(13-15(2)14-27(18)21)16-8-10-17(30-4)11-9-16/h8-11,15H,5-7,12-14H2,1-4H3
InChIKey
ZKIWHYIBALZTSC-UHFFFAOYSA-N
Synonyms
844651-08-7
844651087
9(4METHOXYPHENYL)17DIMETHYL3PENTYL135TRIHYDRO6H7H8H13DIAZAPERHYDROINO(12H)PURINE24DIONE
9(4methoxyphenyl)17dimethyl3pentyl6789tetrahydropyrimido(21f)purine24(1H3H)dione
9(4METHOXYPHENYL)17DIMETHYL3PENTYL78DIHYDRO6HPURINO(78A)PYRIMIDINE24DIONE
CCCCCN1C(=O)C2=C(N=C3N2CC(CN3C4=CC=C(C=C4)OC)C)N(C1=O)C
InChI=1SC22H29N5O3c1567122520(28)1819(24(3)22(25)29)232126(1315(2)1427(18)21)1681017(304)11916h81115H571214H214H3
MFCD04158499
ZINC000005150107
ZINC000005150110

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Available files

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