Vitas-M small molecule compound
4-[5-(7-chloro-2,3-dihydro[1,4]dioxino[2,3-g]quinolin-8-yl)-3-(4-methylphenyl)-4,5-dihydro-1H-pyrazol-1-yl]-4-oxobutanoic acid
Catalog ID
STL336303
SMILES OC(=O)CCC(=O)N1N=C(CC1c1cc2cc3OCCOc3cc2nc1Cl)c1ccc(cc1)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 C25H22ClN3O5 MW 479.92 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H22ClN3O5/c1-14-2-4-15(5-3-14)19-12-20(29(28-19)23(30)6-7-24(31)32)17-10-16-11-21-22(34-9-8-33-21)13-18(16)27-25(17)26/h2-5,10-11,13,20H,6-9,12H2,1H3,(H,31,32)InChIKey
AYXDGABCZKMDBA-UHFFFAOYSA-NSynonyms
683268-09-94(3(7CHLORO23DIHYDRO(14)DIOXINO(23G)QUINOLIN8YL)5(4METHYLPHENYL)34DIHYDROPYRAZOL2YL)4OXOBUTANOICACID
4(5(7chloro23dihydro(14)dioxino(23g)quinolin8yl)3(4methylphenyl)45dihydro1Hpyrazol1yl)4oxobutanoicacid
4(5(7chloro23dihydro(14)dioxino(23g)quinolin8yl)3(ptolyl)45dihydro1Hpyrazol1yl)4oxobutanoicacid
683268099
CC1=CC=C(C=C1)C2=NN(C(C2)C3=C(N=C4C=C5C(=CC4=C3)OCCO5)Cl)C(=O)CCC(=O)O
InChI=1SC25H22ClN3O5c1142415(5314)191220(29(2819)23(30)6724(31)32)171016112122(34983321)1318(16)2725(17)26h2510111320H6912H21H3(H3132)
MFCD03665007
ZINC000009374655
ZINC000013644540
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