Vitas-M small molecule compound

3-(4-fluorophenyl)-4-(4-hydroxy-3-methoxyphenyl)-5-(4-methoxyphenyl)-4,5-dihydropyrrolo[3,4-c]pyrazol-6(2H)-one

Catalog ID
STK632950
SMILES COc1cc(ccc1O)C1N(c2ccc(cc2)OC)C(=O)c2c1c([nH]n2)c1ccc(cc1)F

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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 C25H20FN3O4 MW 445.45 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H20FN3O4/c1-32-18-10-8-17(9-11-18)29-24(15-5-12-19(30)20(13-15)33-2)21-22(27-28-23(21)25(29)31)14-3-6-16(26)7-4-14/h3-13,24,30H,1-2H3,(H,27,28)
InChIKey
CRLKLMDOYUJMOR-UHFFFAOYSA-N
Synonyms
1010893-97-6
1010893976
3(4fluorophenyl)4(4hydroxy3methoxyphenyl)5(4methoxyphenyl)14dihydropyrrolo(34c)pyrazol6one
3(4fluorophenyl)4(4hydroxy3methoxyphenyl)5(4methoxyphenyl)45dihydropyrrolo(34c)pyrazol6(1H)one
3(4fluorophenyl)4(4hydroxy3methoxyphenyl)5(4methoxyphenyl)45dihydropyrrolo(34c)pyrazol6(2H)one
COC1=CC=C(C=C1)N2C(C3=C(C2=O)NN=C3C4=CC=C(C=C4)F)C5=CC(=C(C=C5)O)OC
COc1cc(ccc1O)C1N(c2ccc(cc2)OC)C(=O)c2c1c((nH)n2)c1ccc(cc1)F
COc1cc(ccc1O)C1N(c2ccc(cc2)OC)C(=O)c2c1c(n(nH)2)c1ccc(cc1)F
InChI=1SC25H20FN3O4c1321810817(91118)2924(1551219(30)20(1315)332)2122(272823(21)25(29)31)143616(26)7414h3132430H12H3(H2728)
MFCD18159943
ZINC000012323946
ZINC000012323947

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Available files

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