Vitas-M small molecule compound
(5Z)-3-(1,3-benzodioxol-5-yl)-5-({2,5-dimethyl-1-[4-(morpholin-4-yl)phenyl]-1H-pyrrol-3-yl}methylidene)-6-hydroxypyrimidine-2,4(3H,5H)-dione
Catalog ID
STK616477
SMILES O=C1N=C(O)/C(=C/c2cc(n(c2C)c2ccc(cc2)N2CCOCC2)C)/C(=O)N1c1ccc2c(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 C28H26N4O6 MW 514.54 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H26N4O6/c1-17-13-19(18(2)31(17)21-5-3-20(4-6-21)30-9-11-36-12-10-30)14-23-26(33)29-28(35)32(27(23)34)22-7-8-24-25(15-22)38-16-37-24/h3-8,13-15H,9-12,16H2,1-2H3,(H,29,33,35)/b23-14-InChIKey
UVRRBNDXALHGSM-UCQKPKSFSA-NSynonyms
348577-88-8(5Z)1(13BENZODIOXOL5YL)5((25DIMETHYL1(4MORPHOLIN4YLPHENYL)PYRROL3YL)METHYLIDENE)13DIAZINANE246TRIONE
(5Z)3(13benzodioxol5yl)5((25dimethyl1(4(morpholin4yl)phenyl)1Hpyrrol3yl)methylidene)6hydroxypyrimidine24(3H5H)dione
348577888
CC1=CC(=C(N1C2=CC=C(C=C2)N3CCOCC3)C)C=C4C(=O)NC(=O)N(C4=O)C5=CC6=C(C=C5)OCO6
InChI=1SC28H26N4O6c1171319(18(2)31(17)215320(4621)3091136121030)142326(33)2928(35)32(27(23)34)22782425(1522)38163724h381315H91216H212H3(H293335)b2314
MFCD08731757
O=C1N=C(O)C(=Cc2cc(n(c2C)c2ccc(cc2)N2CCOCC2)C)C(=O)N1c1ccc2c(c1)OCO2
ZINC000013810556
ZINC13810556
Check stock
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Check stock on Vitas-MAvailable files
Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.