Vitas-M small molecule compound
8-[2-(3,4-diethoxyphenyl)ethyl]-1,3-dimethyl-7-(4-methylphenyl)-1H-imidazo[2,1-f]purine-2,4(3H,8H)-dione
Catalog ID
STK784694
SMILES CCOc1cc(ccc1OCC)CCn1c(cn2c1nc1c2c(=O)n(c(=O)n1C)C)c1ccc(cc1)C
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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 C28H31N5O4 MW 501.59 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H31N5O4/c1-6-36-22-13-10-19(16-23(22)37-7-2)14-15-32-21(20-11-8-18(3)9-12-20)17-33-24-25(29-27(32)33)30(4)28(35)31(5)26(24)34/h8-13,16-17H,6-7,14-15H2,1-5H3InChIKey
STKPYQLREADJPE-UHFFFAOYSA-NSynonyms
899371-11-06(2(34DIETHOXYPHENYL)ETHYL)24DIMETHYL7(4METHYLPHENYL)PURINO(78A)IMIDAZOLE13DIONE
8(2(34diethoxyphenyl)ethyl)13dimethyl7(4methylphenyl)1Himidazo(21f)purine24(3H8H)dione
8(34diethoxyphenethyl)13dimethyl7(ptolyl)1Himidazo(21f)purine24(3H8H)dione
899371110
CCOC1=C(C=C(C=C1)CCN2C(=CN3C2=NC4=C3C(=O)N(C(=O)N4C)C)C5=CC=C(C=C5)C)OCC
InChI=1SC28H31N5O4c163622131019(1623(22)3772)14153221(2011818(3)91220)17332425(2927(32)33)30(4)28(35)31(5)26(24)34h8131617H671415H215H3
MFCD07022952
ZINC000009059810
ZINC09059810
ZINC9059810
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