Vitas-M small molecule compound

benzyl [9-(3,5-dimethylphenyl)-1-methyl-2,4-dioxo-1,4,6,7,8,9-hexahydropyrimido[2,1-f]purin-3(2H)-yl]acetate

Catalog ID
STL006434
SMILES Cc1cc(C)cc(c1)N1CCCn2c1nc1c2c(=O)n(c(=O)n1C)CC(=O)OCc1ccccc1

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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 C26H27N5O4 MW 473.53 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H27N5O4/c1-17-12-18(2)14-20(13-17)29-10-7-11-30-22-23(27-25(29)30)28(3)26(34)31(24(22)33)15-21(32)35-16-19-8-5-4-6-9-19/h4-6,8-9,12-14H,7,10-11,15-16H2,1-3H3
InChIKey
HEUIBKYYPVPDKH-UHFFFAOYSA-N
Synonyms
844660-02-2
844660022
benzyl(9(35dimethylphenyl)1methyl24dioxo146789hexahydropyrimido(21f)purin3(2H)yl)acetate
benzyl2(9(35dimethylphenyl)1methyl24dioxo126789hexahydropyrimido(21f)purin3(4H)yl)acetate
BENZYL2(9(35DIMETHYLPHENYL)1METHYL24DIOXO78DIHYDRO6HPURINO(78A)PYRIMIDIN3YL)ACETATE
CC1=CC(=CC(=C1)N2CCCN3C2=NC4=C3C(=O)N(C(=O)N4C)CC(=O)OCC5=CC=CC=C5)C
InChI=1SC26H27N5O4c1171218(2)1420(1317)2910711302223(2725(29)30)28(3)26(34)31(24(22)33)1521(32)3516198546919h46891214H710111516H213H3
MFCD04159734
PHENYLMETHYL2(9(35DIMETHYLPHENYL)1METHYL24DIOXO135TRIHYDRO6H7H8H13DIAZAPERHYDROINO(12H)PURIN3YL)ACETATE
ZINC000004039917
ZINC04039917
ZINC4039917

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Available files

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