Vitas-M small molecule compound
3-hexyl-1,7-dimethyl-9-(3-methylphenyl)-6,7,8,9-tetrahydropyrimido[2,1-f]purine-2,4(1H,3H)-dione
Catalog ID
STL003083
SMILES CCCCCCn1c(=O)n(C)c2c(c1=O)n1CC(C)CN(c1n2)c1cccc(c1)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 C23H31N5O2 MW 409.53 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H31N5O2/c1-5-6-7-8-12-26-21(29)19-20(25(4)23(26)30)24-22-27(14-17(3)15-28(19)22)18-11-9-10-16(2)13-18/h9-11,13,17H,5-8,12,14-15H2,1-4H3InChIKey
YTERDFPIZKUPCP-UHFFFAOYSA-NSynonyms
844830-23-53HEXYL17DIMETHYL9(3METHYLPHENYL)135TRIHYDRO6H7H8H13DIAZAPERHYDROINO(12H)PURINE24DIONE
3hexyl17dimethyl9(3methylphenyl)6789tetrahydropyrimido(21f)purine24(1H3H)dione
3HEXYL17DIMETHYL9(3METHYLPHENYL)78DIHYDRO6HPURINO(78A)PYRIMIDINE24DIONE
3hexyl17dimethyl9(mtolyl)6789tetrahydropyrimido(21f)purine24(1H3H)dione
844830235
CCCCCCN1C(=O)C2=C(N=C3N2CC(CN3C4=CC=CC(=C4)C)C)N(C1=O)C
InChI=1SC23H31N5O2c15678122621(29)1920(25(4)23(26)30)242227(1417(3)1528(19)22)181191016(2)1318h9111317H58121415H214H3
MFCD04161754
ZINC000012374070
ZINC000012374071
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