Vitas-M small molecule compound
4-(3,4-dichlorophenyl)-2-phenyl-4,7,8,9-tetrahydro-1H-pyrazolo[3,4-b]quinoline-3,5(2H,6H)-dione
Catalog ID
STK333579
SMILES O=C1CCCC2=C1C(c1ccc(c(c1)Cl)Cl)c1c(N2)[nH]n(c1=O)c1ccccc1
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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 C22H17Cl2N3O2 MW 426.30 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H17Cl2N3O2/c23-14-10-9-12(11-15(14)24)18-19-16(7-4-8-17(19)28)25-21-20(18)22(29)27(26-21)13-5-2-1-3-6-13/h1-3,5-6,9-11,18,25-26H,4,7-8H2InChIKey
OAQLJFMJSUJXHE-UHFFFAOYSA-NSynonyms
4(34dichlorophenyl)2phenyl146789hexahydropyrazolo(34b)quinoline35dione
4(34dichlorophenyl)2phenyl4789tetrahydro1Hpyrazolo(34b)quinoline35(2H6H)dione
C1CC2=C(C(C3=C(N2)NN(C3=O)C4=CC=CC=C4)C5=CC(=C(C=C5)Cl)Cl)C(=O)C1
InChI=1SC22H17Cl2N3O2c231410912(1115(14)24)181916(74817(19)28)252120(18)22(29)27(2621)135213613h1356911182526H478H2
MFCD09963162
O=C1CCCC2=C1C(c1ccc(c(c1)Cl)Cl)c1c(N2)(nH)n(c1=O)c1ccccc1
ZINC000018196062
ZINC000018196063
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