Vitas-M small molecule compound

8-(3,4-dimethylphenyl)-3-(2-methoxyethyl)-1,6,7-trimethyl-1H-imidazo[2,1-f]purine-2,4(3H,8H)-dione

Catalog ID
STK851285
SMILES COCCn1c(=O)n(C)c2c(c1=O)n1c(n2)n(c(c1C)C)c1ccc(c(c1)C)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 C21H25N5O3 MW 395.46 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H25N5O3/c1-12-7-8-16(11-13(12)2)25-14(3)15(4)26-17-18(22-20(25)26)23(5)21(28)24(19(17)27)9-10-29-6/h7-8,11H,9-10H2,1-6H3
InChIKey
LPBUMQOWDOJBPX-UHFFFAOYSA-N
Synonyms
896803-59-1
6(34dimethylphenyl)2(2methoxyethyl)478trimethylpurino(78a)imidazole13dione
8(34DIMETHYLPHENYL)3(2METHOXYETHYL)167TRIMETHYL135TRIHYDRO4IMIDAZOLINO(12H)PURINE24DIONE
8(34dimethylphenyl)3(2methoxyethyl)167trimethyl1Himidazo(21f)purine24(3H8H)dione
896803591
CC1=C(C=C(C=C1)N2C(=C(N3C2=NC4=C3C(=O)N(C(=O)N4C)CCOC)C)C)C
InChI=1SC21H25N5O3c1127816(1113(12)2)2514(3)15(4)261718(2220(25)26)23(5)21(28)24(19(17)27)910296h7811H910H216H3
MFCD06593142
ZINC000012374141
ZINC12374141

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Available files

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