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(2E)-1-(2,4-dihydroxyphenyl)-3-(4-methoxyphenyl)prop-2-en-1-one

(2E)-1-(2,4-dihydroxyphenyl)-3-(4-methoxyphenyl)prop-2-en-1-one - CAS 13351-10-5

Name: (2E)-1-(2,4-dihydroxyphenyl)-3-(4-methoxyphenyl)prop-2-en-1-one
Brand: BOC Sciences
Rating: 5 (1 reviews)

Catalog:	BB055808
Product Name:	(2E)-1-(2,4-dihydroxyphenyl)-3-(4-methoxyphenyl)prop-2-en-1-one
CAS:	13351-10-5
Synonyms:	C16H14O4

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Computed Properties

IUPAC Name:	(E)-1-(2,4-dihydroxyphenyl)-3-(4-methoxyphenyl)prop-2-en-1-one
Description:	(2E)-1-(2,4-dihydroxyphenyl)-3-(4-methoxyphenyl)prop-2-en-1-one (cas# 13351-10-5) is a useful research chemical.
Molecular Weight:	270.28
Molecular Formula:	C16H14O4
Canonical SMILES:	COC1=CC=C(C=C1)C=CC(=O)C2=C(C=C(C=C2)O)O
InChI:	InChI=1S/C16H14O4/c1-20-13-6-2-11(3-7-13)4-9-15(18)14-8-5-12(17)10-16(14)19/h2-10,17,19H,1H3/b9-4+
InChI Key:	ADRQFDIWPRFKSP-RUDMXATFSA-N

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GHS Hazard Statement:	H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]
Precautionary Statement:	P264, P270, P301+P317, P330, and P501
Signal Word:	Warning

Publication Number	Title	Priority Date
WO-2022015740-A1	Compositions and methods of treating ups-associated diseases	20200713
CN-106166145-A	The new application of chalcone compounds	20150521
US-2014350304-A1	Composition for treating diabetes and metabolic diseases and a preparation method thereof	20110810
US-9085520-B2	Composition for treating diabetes and metabolic diseases and a preparation method thereof	20110810
WO-2013022951-A1	Composition for treating diabetes and metabolic diseases and a preparation method thereof	20110810
US-2007265317-A1	Modified chalcone compounds as antimitotic agents	20060510
US-2010222380-A1	Modified Chalcone Compounds as Antimitotic Agents	20060510
US-7714025-B2	Modified chalcone compounds as antimitotic agents	20060510
EP-1888174-B1	Use of chalcones for the treatment of viral disorders	20050524
US-2006270614-A1	Use of chalcones for the treatment of viral disorders	20050524

PMID	Publication Date	Title	Journal
22608392	20120615	Synthesis of chalcone derivatives as potential anti-diabetic agents	Bioorganic & medicinal chemistry letters
22112540	20120101	Investigation of chalcones and benzochalcones as inhibitors of breast cancer resistance protein	Bioorganic & medicinal chemistry
22177409	20120101	Solid-phase synthesis of 2'-hydroxychalcones. Effects on cell growth inhibition, cell cycle and apoptosis of human tumor cell lines	Bioorganic & medicinal chemistry
19807106	20091112	7-Hydroxy-benzopyran-4-one derivatives: a novel pharmacophore of peroxisome proliferator-activated receptor alpha and -gamma (PPARalpha and gamma) dual agonists	Journal of medicinal chemistry
18603336	20090501	Synthesis of (+/-)Abyssinone I and related compounds: Their anti-oxidant and cytotoxic activities	European journal of medicinal chemistry
17502148	20070715	Discovery of structurally diverse HIV-1 integrase inhibitors based on a chalcone pharmacophore	Bioorganic & medicinal chemistry
17125223	20061101	Protein tyrosine phosphatase-1B inhibitory activity of isoprenylated flavonoids isolated from Erythrina mildbraedii	Journal of natural products
15225696	20040802	A convenient and biogenetic type synthesis of few naturally occurring chromeno dihydrochalcones and their in vitro antileishmanial activity	Bioorganic & medicinal chemistry letters

Complexity:	344
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	1
Defined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	1
Exact Mass:	270.08920892
Formal Charge:	0
Heavy Atom Count:	20
Hydrogen Bond Acceptor Count:	4
Hydrogen Bond Donor Count:	2
Isotope Atom Count:	0
Monoisotopic Mass:	270.08920892
Rotatable Bond Count:	4
Topological Polar Surface Area:	66.8Å²
Undefined Atom Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0
XLogP3:	3.7