Vitas-M small molecule compound
5-[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]-5-oxopentanoic acid
Catalog ID
STL336702
SMILES OC(=O)CCCC(=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 C26H24ClN3O5 MW 493.95 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H24ClN3O5/c1-15-5-7-16(8-6-15)20-13-21(30(29-20)24(31)3-2-4-25(32)33)18-11-17-12-22-23(35-10-9-34-22)14-19(17)28-26(18)27/h5-8,11-12,14,21H,2-4,9-10,13H2,1H3,(H,32,33)InChIKey
MTVQNJJJBXFRAA-UHFFFAOYSA-NSynonyms
683268-10-25(3(7CHLORO23DIHYDRO(14)DIOXINO(23G)QUINOLIN8YL)5(4METHYLPHENYL)34DIHYDROPYRAZOL2YL)5OXOPENTANOICACID
5(5(7chloro23dihydro(14)dioxino(23g)quinolin8yl)3(4methylphenyl)45dihydro1Hpyrazol1yl)5oxopentanoicacid
5(5(7CHLORO23DIHYDRO(14)DIOXINO(23G)QUINOLIN8YL)3(PTOLYL)45DIHYDRO1HPYRAZOL1YL)5OXOPENTANOICACID
683268102
CC1=CC=C(C=C1)C2=NN(C(C2)C3=C(N=C4C=C5C(=CC4=C3)OCCO5)Cl)C(=O)CCCC(=O)O
InChI=1SC26H24ClN3O5c1155716(8615)201321(30(2920)24(31)32425(32)33)181117122223(351093422)1419(17)2826(18)27h5811121421H2491013H21H3(H3233)
MFCD03668319
ZINC000009360241
ZINC000009360244
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