Vitas-M small molecule compound
3-(1,3-benzodioxol-5-yl)-7-[(4-fluorobenzyl)amino]pyrimido[4,5-d]pyrimidine-2,4(1H,3H)-dione
Catalog ID
STL126597
SMILES Fc1ccc(cc1)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 C20H14FN5O4 MW 407.36 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H14FN5O4/c21-12-3-1-11(2-4-12)8-22-19-23-9-14-17(24-19)25-20(28)26(18(14)27)13-5-6-15-16(7-13)30-10-29-15/h1-7,9H,8,10H2,(H2,22,23,24,25,28)InChIKey
YACYNEKJLWVJIM-UHFFFAOYSA-NSynonyms
3(13benzodioxol5yl)7((4fluorobenzyl)amino)pyrimido(45d)pyrimidine24(1H3H)dione
6(13benzodioxol5yl)2((4fluorophenyl)methylamino)8Hpyrimido(45d)pyrimidine57dione
C1OC2=C(O1)C=C(C=C2)N3C(=O)C4=CN=C(N=C4NC3=O)NCC5=CC=C(C=C5)F
Fc1ccc(cc1)CNc1ncc2c(n1)(nH)c(=O)n(c2=O)c1ccc2c(c1)OCO2
InChI=1SC20H14FN5O4c21123111(2412)822192391417(2419)2520(28)26(18(14)27)13561516(713)30102915h179H810H2(H22223242528)
MFCD20739226
ZINC000102911807
ZINC102911807
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