Vitas-M small molecule compound

3-(2,5-dimethylbenzyl)-1-methyl-9-(3-methylphenyl)-6,7,8,9-tetrahydropyrimido[2,1-f]purine-2,4(1H,3H)-dione

Catalog ID
STL005504
SMILES Cc1ccc(c(c1)Cn1c(=O)c2n3CCCN(c3nc2n(c1=O)C)c1cccc(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 C25H27N5O2 MW 429.52 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H27N5O2/c1-16-7-5-8-20(14-16)28-11-6-12-29-21-22(26-24(28)29)27(4)25(32)30(23(21)31)15-19-13-17(2)9-10-18(19)3/h5,7-10,13-14H,6,11-12,15H2,1-4H3
InChIKey
WHFQRMQLXAUMQX-UHFFFAOYSA-N
Synonyms
844824-66-4
3((25DIMETHYLPHENYL)METHYL)1METHYL9(3METHYLPHENYL)135TRIHYDRO6H7H8H13DIAZAPERHYDROINO(12H)PURINE24DIONE
3((25DIMETHYLPHENYL)METHYL)1METHYL9(3METHYLPHENYL)78DIHYDRO6HPURINO(78A)PYRIMIDINE24DIONE
3(25dimethylbenzyl)1methyl9(3methylphenyl)6789tetrahydropyrimido(21f)purine24(1H3H)dione
3(25dimethylbenzyl)1methyl9(mtolyl)6789tetrahydropyrimido(21f)purine24(1H3H)dione
844824664
CC1=CC(=CC=C1)N2CCCN3C2=NC4=C3C(=O)N(C(=O)N4C)CC5=C(C=CC(=C5)C)C
InChI=1SC25H27N5O2c11675820(1416)2811612292122(2624(28)29)27(4)25(32)30(23(21)31)15191317(2)91018(19)3h57101314H6111215H214H3
MFCD04161223
ZINC000009192899
ZINC09192899
ZINC9192899

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Available files

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