Vitas-M small molecule compound
3-(1,3-benzodioxol-5-yl)-7-[(2,4-difluorobenzyl)amino]pyrimido[4,5-d]pyrimidine-2,4(1H,3H)-dione
Catalog ID
STL126598
SMILES Fc1ccc(c(c1)F)CNc1ncc2c(n1)[nH]c(=O)n(c2=O)c1ccc2c(c1)OCO2
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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 C20H13F2N5O4 MW 425.35 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H13F2N5O4/c21-11-2-1-10(14(22)5-11)7-23-19-24-8-13-17(25-19)26-20(29)27(18(13)28)12-3-4-15-16(6-12)31-9-30-15/h1-6,8H,7,9H2,(H2,23,24,25,26,29)InChIKey
FNSHFFBSOXOUJC-UHFFFAOYSA-NSynonyms
3(13benzodioxol5yl)7((24difluorobenzyl)amino)pyrimido(45d)pyrimidine24(1H3H)dione
6(13benzodioxol5yl)2((24difluorophenyl)methylamino)8Hpyrimido(45d)pyrimidine57dione
C1OC2=C(O1)C=C(C=C2)N3C(=O)C4=CN=C(N=C4NC3=O)NCC5=C(C=C(C=C5)F)F
Fc1ccc(c(c1)F)CNc1ncc2c(n1)(nH)c(=O)n(c2=O)c1ccc2c(c1)OCO2
InChI=1SC20H13F2N5O4c21112110(14(22)511)723192481317(2519)2620(29)27(18(13)28)12341516(612)3193015h168H79H2(H22324252629)
MFCD20739227
ZINC000067261563
ZINC67261563
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