PFI-3

cas: 1819363-80-8 — see every product listed under this CAS number, including other names

PFI-3 (CAS 1819363-80-8) is a chemical reagent available from Chemat. Available pack sizes: 250mg. Offered by: TRC.

brandTRC
catalog numberTRC-P294065-250MG
cas1819363-80-8
size250mg
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Available pack sizes

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TRC 250mg price on request

properties

purityNo data
delivery timeTo be confirmed by Chemat
Structural formula: {0} (CAS {1})

PFI-3 is an azabicycloalkane that is (1R,4R)-2,5-diazabicyclo[2.2.1]heptane which is substituted at position 2 by a 3-(2-hydroxyphenyl)-3-oxoprop-1-en-1-yl group and at position 5 by a pyridin-2-yl group. It is a potent and selective inhibitor of polybromo 1 (Kd = 48 nM), SMARCA2 and SMARCA4 (Kd = 89 nM) bromodomains. It is a member of pyridines, a member of phenols, an azabicycloalkane and an enone.

Source: ChEBI

Identity
Molecular formulaC19H19N3O2
Molecular weight321.4 g/mol
IUPAC name(E)-1-(2-hydroxyphenyl)-3-[(1R,4R)-5-pyridin-2-yl-2,5-diazabicyclo[2.2.1]heptan-2-yl]prop-2-en-1-one
InChIKeyINAICWLVUAKEPB-QSTFCLMHSA-N
SMILESC1[C@@H]2CN([C@H]1CN2C3=CC=CC=N3)/C=C/C(=O)C4=CC=CC=C4O

Computed by PubChem (NCBI)

Synonyms: compound 16 [PMID: 27115555], compound 16 (PMID: 27115555), orb1225874, orb1300329
Isomers (same molecular formula)
2-(4-propan-2-yloxyphenyl)quinoline-4-carbohydrazide C19H19N3O2
4-(1H-benzimidazol-2-yl)-1-(4-ethoxyphenyl)pyrrolidin-2-one C19H19N3O2
4-(4-acetylanilino)-1,5-dimethyl-2-phenylpyrazol-3-one C19H19N3O2
4-tert-butyl-N-(4-oxopyrido[1,2-a]pyrimidin-3-yl)benzamide C19H19N3O2
2-(3-propan-2-yloxyphenyl)quinoline-4-carbohydrazide C19H19N3O2
2-(4-ethoxyphenyl)-6-methylquinoline-4-carbohydrazide C19H19N3O2
4-(1H-benzimidazol-2-yl)-1-[(4-methoxyphenyl)methyl]pyrrolidin-2-one C19H19N3O2
N,N-dimethyl-2-[6-methyl-2-(4-methylphenyl)imidazo[1,2-a]pyridin-3-yl]-2-oxoacetamide C19H19N3O2
1-cyclopentyl-3-methyl-6-phenylpyrazolo[5,4-b]pyridine-4-carboxylic acid C19H19N3O2
3-cyclopropyl-1-phenyl-6-propan-2-ylpyrazolo[5,4-b]pyridine-4-carboxylic acid C19H19N3O2
2-[4-[(3S)-piperidin-3-yl]phenyl]indazole-7-carboxylic acid C19H19N3O2
(2Z)-2-[(3,5-dimethyl-1H-pyrrol-2-yl)-(4-nitrophenyl)methylidene]-3,5-dimethylpyrrole C19H19N3O2

Also listed as

PFI 3 GLPBio CAS 1819363-80-8
PFI-3/ 99.71% (existing batch purity) TargetMol CAS 1819363-80-8
PFI-3 99+% Ambeed CAS 1819363-80-8
PFI-3, 99+%, 99+% Chemat CAS 1819363-80-8
PFI-3, 99.63% MedChemExpress CAS 1819363-80-8
PFI-3, 99+% Fluorochem CAS 1819363-80-8