Vitas-M small molecule compound

5-[2-(1H-indol-3-yl)ethyl]-3-(4-methoxyphenyl)-4-(pyridin-2-yl)-4,5-dihydropyrrolo[3,4-c]pyrazol-6(2H)-one

Catalog ID
STK633500
SMILES COc1ccc(cc1)c1[nH]nc2c1C(c1ccccn1)N(C2=O)CCc1c[nH]c2c1cccc2

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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 C27H23N5O2 MW 449.51 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H23N5O2/c1-34-19-11-9-17(10-12-19)24-23-25(31-30-24)27(33)32(26(23)22-8-4-5-14-28-22)15-13-18-16-29-21-7-3-2-6-20(18)21/h2-12,14,16,26,29H,13,15H2,1H3,(H,30,31)
InChIKey
LRCCZZCKSMESOW-UHFFFAOYSA-N
Synonyms
1010891-30-1
1010891301
5(2(1Hindol3yl)ethyl)3(4methoxyphenyl)4(pyridin2yl)45dihydropyrrolo(34c)pyrazol6(1H)one
5(2(1Hindol3yl)ethyl)3(4methoxyphenyl)4(pyridin2yl)45dihydropyrrolo(34c)pyrazol6(2H)one
5(2(1Hindol3yl)ethyl)3(4methoxyphenyl)4pyridin2yl14dihydropyrrolo(34c)pyrazol6one
COC1=CC=C(C=C1)C2=NNC3=C2C(N(C3=O)CCC4=CNC5=CC=CC=C54)C6=CC=CC=N6
COc1ccc(cc1)c1(nH)nc2c1C(c1ccccn1)N(C2=O)CCc1c(nH)c2c1cccc2
COc1ccc(cc1)c1n(nH)c2c1C(c1ccccn1)N(C2=O)CCc1c(nH)c2c1cccc2
InChI=1SC27H23N5O2c1341911917(101219)242325(313024)27(33)32(26(23)22845142822)151318162921732620(18)21h21214162629H1315H21H3(H3031)
MFCD18160115
ZINC000012323745
ZINC000012323746

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.