Vitas-M small molecule compound
7-hydroxy-1-methyl-9-(4-methylphenyl)-3-pentyl-6,7,8,9-tetrahydropyrimido[2,1-f]purine-2,4(1H,3H)-dione
Catalog ID
STK582988
SMILES CCCCCn1c(=O)n(C)c2c(c1=O)n1CC(O)CN(c1n2)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 C21H27N5O3 MW 397.48 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H27N5O3/c1-4-5-6-11-24-19(28)17-18(23(3)21(24)29)22-20-25(12-16(27)13-26(17)20)15-9-7-14(2)8-10-15/h7-10,16,27H,4-6,11-13H2,1-3H3InChIKey
MJCKLIMCDZIRKH-UHFFFAOYSA-NSynonyms
844655-27-27hydroxy1methyl3pentyl9(ptolyl)6789tetrahydropyrimido(21f)purine24(1H3H)dione
7HYDROXY1METHYL9(4METHYLPHENYL)3PENTYL135TRIHYDRO6H7H8H13DIAZAPERHYDROINO(12H)PURINE24DIONE
7hydroxy1methyl9(4methylphenyl)3pentyl6789tetrahydropyrimido(21f)purine24(1H3H)dione
7HYDROXY1METHYL9(4METHYLPHENYL)3PENTYL78DIHYDRO6HPURINO(78A)PYRIMIDINE24DIONE
844655272
CCCCCN1C(=O)C2=C(N=C3N2CC(CN3C4=CC=C(C=C4)C)O)N(C1=O)C
InChI=1SC21H27N5O3c1456112419(28)1718(23(3)21(24)29)222025(1216(27)1326(17)20)159714(2)81015h7101627H461113H213H3
MFCD04158822
ZINC000005209076
ZINC000005209078
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