Vitas-M small molecule compound

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

Catalog ID
STL005585
SMILES CCCCCCCCCn1c(=O)c2n3CC(C)CN(c3nc2n(c1=O)C)c1ccc(cc1)OCC

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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 C27H39N5O3 MW 481.64 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H39N5O3/c1-5-7-8-9-10-11-12-17-30-25(33)23-24(29(4)27(30)34)28-26-31(18-20(3)19-32(23)26)21-13-15-22(16-14-21)35-6-2/h13-16,20H,5-12,17-19H2,1-4H3
InChIKey
VMKTUQXJICMWTB-UHFFFAOYSA-N
Synonyms
847164-64-1
847164641
9(4ETHOXYPHENYL)17DIMETHYL3NONYL135TRIHYDRO6H7H8H13DIAZAPERHYDROINO(12H)PURINE24DIONE
9(4ethoxyphenyl)17dimethyl3nonyl6789tetrahydropyrimido(21f)purine24(1H3H)dione
9(4ETHOXYPHENYL)17DIMETHYL3NONYL78DIHYDRO6HPURINO(78A)PYRIMIDINE24DIONE
CCCCCCCCCN1C(=O)C2=C(N=C3N2CC(CN3C4=CC=C(C=C4)OCC)C)N(C1=O)C
InChI=1SC27H39N5O3c15789101112173025(33)2324(29(4)27(30)34)282631(1820(3)1932(23)26)21131522(161421)3562h131620H5121719H214H3
MFCD04183319
ZINC000097954637
ZINC000097954638

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Available files

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