Vitas-M small molecule compound
3-(2,5-dimethylbenzyl)-9-(4-ethoxyphenyl)-1-methyl-6,7,8,9-tetrahydropyrimido[2,1-f]purine-2,4(1H,3H)-dione
Catalog ID
STL003895
SMILES CCOc1ccc(cc1)N1CCCn2c1nc1c2c(=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 C26H29N5O3 MW 459.55 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H29N5O3/c1-5-34-21-11-9-20(10-12-21)29-13-6-14-30-22-23(27-25(29)30)28(4)26(33)31(24(22)32)16-19-15-17(2)7-8-18(19)3/h7-12,15H,5-6,13-14,16H2,1-4H3InChIKey
YXQBHDUGTQDIPX-UHFFFAOYSA-NSynonyms
847246-56-43((25DIMETHYLPHENYL)METHYL)9(4ETHOXYPHENYL)1METHYL135TRIHYDRO6H7H8H13DIAZAPERHYDROINO(12H)PURINE24DIONE
3((25DIMETHYLPHENYL)METHYL)9(4ETHOXYPHENYL)1METHYL78DIHYDRO6HPURINO(78A)PYRIMIDINE24DIONE
3(25dimethylbenzyl)9(4ethoxyphenyl)1methyl6789tetrahydropyrimido(21f)purine24(1H3H)dione
847246564
CCOC1=CC=C(C=C1)N2CCCN3C2=NC4=C3C(=O)N(C(=O)N4C)CC5=C(C=CC(=C5)C)C
InChI=1SC26H29N5O3c15342111920(101221)2913614302223(2725(29)30)28(4)26(33)31(24(22)32)16191517(2)7818(19)3h71215H56131416H214H3
MFCD04174733
ZINC000009282418
ZINC09282418
ZINC9282418
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