Vitas-M small molecule compound

4-(4-tert-butylphenyl)-3-(5-chloro-2-hydroxy-4-methylphenyl)-5-(3-hydroxypropyl)-4,5-dihydropyrrolo[3,4-c]pyrazol-6(2H)-one

Catalog ID
STK577252
SMILES OCCCN1C(=O)c2c(C1c1ccc(cc1)C(C)(C)C)c([nH]n2)c1cc(Cl)c(cc1O)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 C25H28ClN3O3 MW 453.97 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H28ClN3O3/c1-14-12-19(31)17(13-18(14)26)21-20-22(28-27-21)24(32)29(10-5-11-30)23(20)15-6-8-16(9-7-15)25(2,3)4/h6-9,12-13,23,30-31H,5,10-11H2,1-4H3,(H,27,28)
InChIKey
AHTSQHDJVGKHLN-UHFFFAOYSA-N
Synonyms
880394-32-1
4(4(tertbutyl)phenyl)3(5chloro2hydroxy4methylphenyl)5(3hydroxypropyl)45dihydropyrrolo(34c)pyrazol6(1H)one
4(4tertbutylphenyl)3(5chloro2hydroxy4methylphenyl)5(3hydroxypropyl)45dihydropyrrolo(34c)pyrazol6(2H)one
880394321
MFCD07200340
OCCCN1C(=O)c2c(C1c1ccc(cc1)C(C)(C)C)c((nH)n2)c1cc(Cl)c(cc1O)C
OCCCN1C(c2ccc(cc2)C(C)(C)C)c2c(C1=O)(nH)nc2c1cc(Cl)c(cc1O)C
ZINC000009243252
ZINC000009243253

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Available files

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