Vitas-M small molecule compound

1-methyl-3-(3-methylbutyl)-9-(4-methylphenyl)-6,7,8,9-tetrahydropyrimido[2,1-f]purine-2,4(1H,3H)-dione

Catalog ID
STL343032
SMILES CC(CCn1c(=O)n(C)c2c(c1=O)n1CCCN(c1n2)c1ccc(cc1)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 C21H27N5O2 MW 381.48 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H27N5O2/c1-14(2)10-13-26-19(27)17-18(23(4)21(26)28)22-20-24(11-5-12-25(17)20)16-8-6-15(3)7-9-16/h6-9,14H,5,10-13H2,1-4H3
InChIKey
BAVLGEURHHDALH-UHFFFAOYSA-N
Synonyms
844825-61-2
1METHYL3(3METHYLBUTYL)9(4METHYLPHENYL)135TRIHYDRO6H7H8H13DIAZAPERHYDROINO(12H)PURINE24DIONE
1methyl3(3methylbutyl)9(4methylphenyl)6789tetrahydropyrimido(21f)purine24(1H3H)dione
1METHYL3(3METHYLBUTYL)9(4METHYLPHENYL)78DIHYDRO6HPURINO(78A)PYRIMIDINE24DIONE
3isopentyl1methyl9(ptolyl)6789tetrahydropyrimido(21f)purine24(1H3H)dione
844825612
CC1=CC=C(C=C1)N2CCCN3C2=NC4=C3C(=O)N(C(=O)N4C)CCC(C)C
InChI=1SC21H27N5O2c114(2)10132619(27)1718(23(4)21(26)28)222024(1151225(17)20)168615(3)7916h6914H51013H214H3
MFCD04161305
ZINC000012373993
ZINC12373993

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Available files

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