Vitas-M small molecule compound

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

Catalog ID
STL005940
SMILES O=c1n(C)c2nc3n(c2c(=O)n1Cc1ccccc1)CCCN3c1ccc(cc1)Oc1ccccc1

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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 C28H25N5O3 MW 479.54 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H25N5O3/c1-30-25-24(26(34)33(28(30)35)19-20-9-4-2-5-10-20)32-18-8-17-31(27(32)29-25)21-13-15-23(16-14-21)36-22-11-6-3-7-12-22/h2-7,9-16H,8,17-19H2,1H3
InChIKey
CCOFLMXHRMJILI-UHFFFAOYSA-N
Synonyms
850244-30-3
1METHYL3BENZYL9(4PHENOXYPHENYL)135TRIHYDRO6H7H8H13DIAZAPERHYDROINO(12H)PURINE24DIONE
3benzyl1methyl9(4phenoxyphenyl)6789tetrahydropyrimido(21f)purine24(1H3H)dione
3BENZYL1METHYL9(4PHENOXYPHENYL)78DIHYDRO6HPURINO(78A)PYRIMIDINE24DIONE
850244303
CN1C2=C(C(=O)N(C1=O)CC3=CC=CC=C3)N4CCCN(C4=N2)C5=CC=C(C=C5)OC6=CC=CC=C6
InChI=1SC28H25N5O3c1302524(26(34)33(28(30)35)192094251020)321881731(27(32)2925)21131523(161421)3622116371222h27916H81719H21H3
MFCD05692228
ZINC000009290558
ZINC09290558
ZINC9290558

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Available files

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