Vitas-M small molecule compound

methyl 3-[1,7-dimethyl-2,4-dioxo-8-(2-phenylethyl)-1,2,4,8-tetrahydro-3H-imidazo[2,1-f]purin-3-yl]propanoate

Catalog ID
STK853204
SMILES COC(=O)CCn1c(=O)n(C)c2c(c1=O)n1cc(n(c1n2)CCc1ccccc1)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 C21H23N5O4 MW 409.44 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H23N5O4/c1-14-13-26-17-18(22-20(26)24(14)11-9-15-7-5-4-6-8-15)23(2)21(29)25(19(17)28)12-10-16(27)30-3/h4-8,13H,9-12H2,1-3H3
InChIKey
JQEQJBRKRPRRIC-UHFFFAOYSA-N
Synonyms
899391-62-9
899391629
CC1=CN2C3=C(N=C2N1CCC4=CC=CC=C4)N(C(=O)N(C3=O)CCC(=O)OC)C
InChI=1SC21H23N5O4c11413261718(2220(26)24(14)119157546815)23(2)21(29)25(19(17)28)121016(27)303h4813H912H213H3
methyl3(17dimethyl24dioxo8(2phenylethyl)1248tetrahydro3Himidazo(21f)purin3yl)propanoate
METHYL3(17DIMETHYL24DIOXO8(2PHENYLETHYL)135TRIHYDRO4IMIDAZOLINO(12H)PURIN3YL)PROPANOATE
METHYL3(17DIMETHYL24DIOXO8PHENETHYL1HIMIDAZO(21F)PURIN3(2H4H8H)YL)PROPANOATE
methyl3(47dimethyl13dioxo6(2phenylethyl)purino(78a)imidazol2yl)propanoate
METHYL3(47DIMETHYL13DIOXO6PHENETHYLPURINO(78A)IMIDAZOL2YL)PROPANOATE
MFCD06609054
ZINC000013540806
ZINC13540806

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Available files

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