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4'-Chloro-2'-(2,5-dimethoxy-4-pyridinyl)acetophenone

4'-Chloro-2'-(2,5-dimethoxy-4-pyridinyl)acetophenone - CAS 2201839-84-9

Catalog:	BB017279
Product Name:	4'-Chloro-2'-(2,5-dimethoxy-4-pyridinyl)acetophenone
CAS:	2201839-84-9
Synonyms:	1-[4-chloro-2-(2,5-dimethoxy-4-pyridinyl)phenyl]ethanone; 1-[4-chloro-2-(2,5-dimethoxypyridin-4-yl)phenyl]ethanone

Technical Data

Patents

Computed Properties

IUPAC Name:	1-[4-chloro-2-(2,5-dimethoxypyridin-4-yl)phenyl]ethanone
Description:	4'-Chloro-2'-(2,5-dimethoxy-4-pyridinyl)acetophenone (CAS# 2201839-84-9 ) is a useful research chemical.
Molecular Weight:	291.73
Molecular Formula:	C15H14ClNO3
Canonical SMILES:	CC(=O)C1=C(C=C(C=C1)Cl)C2=CC(=NC=C2OC)OC
InChI:	InChI=1S/C15H14ClNO3/c1-9(18)11-5-4-10(16)6-12(11)13-7-15(20-3)17-8-14(13)19-2/h4-8H,1-3H3
InChI Key:	VOKAEJLSRIKUBB-UHFFFAOYSA-N

Publication Number	Title	Priority Date
CN-112675173-A	Medical application of FXIa inhibitor compound or salt thereof	20201225
CN-111233756-A	Pharmaceutically acceptable salt of oxopyridine amide derivative and preparation method thereof	20200320
WO-2021057818-A1	Fxia inhibitors and preparation method therefor and pharmaceutical use thereof	20190927
CN-111094241-A	Crystal form of oxopyridine amide derivative and preparation method thereof	20180227
TW-201936580-A	Crystal form of ketopyrazine derivative and preparation method thereof	20180227

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Complexity:	339
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	1
Defined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Exact Mass:	291.066221
Formal Charge:	0
Heavy Atom Count:	20
Hydrogen Bond Acceptor Count:	4
Hydrogen Bond Donor Count:	0
Isotope Atom Count:	0
Monoisotopic Mass:	291.066221
Rotatable Bond Count:	4
Topological Polar Surface Area:	48.4
Undefined Atom Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0
XLogP3:	3.1