Vitas-M small molecule compound
3-(2,5-dimethylbenzyl)-9-(4-ethoxyphenyl)-1,7-dimethyl-6,7,8,9-tetrahydropyrimido[2,1-f]purine-2,4(1H,3H)-dione
Catalog ID
STL002651
SMILES CCOc1ccc(cc1)N1CC(C)Cn2c1nc1c2c(=O)n(c(=O)n1C)Cc1cc(C)ccc1C
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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 C27H31N5O3 MW 473.58 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H31N5O3/c1-6-35-22-11-9-21(10-12-22)30-14-18(3)15-31-23-24(28-26(30)31)29(5)27(34)32(25(23)33)16-20-13-17(2)7-8-19(20)4/h7-13,18H,6,14-16H2,1-5H3InChIKey
BBAQDQYCRBVWSK-UHFFFAOYSA-NSynonyms
845669-88-73((25DIMETHYLPHENYL)METHYL)9(4ETHOXYPHENYL)17DIMETHYL135TRIHYDRO6H7H8H13DIAZAPERHYDROINO(12H)PURINE24DIONE
3((25DIMETHYLPHENYL)METHYL)9(4ETHOXYPHENYL)17DIMETHYL78DIHYDRO6HPURINO(78A)PYRIMIDINE24DIONE
3(25dimethylbenzyl)9(4ethoxyphenyl)17dimethyl6789tetrahydropyrimido(21f)purine24(1H3H)dione
845669887
CCOC1=CC=C(C=C1)N2CC(CN3C2=NC4=C3C(=O)N(C(=O)N4C)CC5=C(C=CC(=C5)C)C)C
InChI=1SC27H31N5O3c16352211921(101222)301418(3)15312324(2826(30)31)29(5)27(34)32(25(23)33)16201317(2)7819(20)4h71318H61416H215H3
MFCD04169501
ZINC000009110206
ZINC000009110207
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