Ethyl 4-Oxo-7-(4-pyridyl)-1,4-dihydroquinoline-3-carboxylate - CAS 40034-41-1

Name: Ethyl 4-Oxo-7-(4-pyridyl)-1,4-dihydroquinoline-3-carboxylate
Brand: BOC Sciences
Rating: 5 (1 reviews)

Catalog:	BB024262
Product Name:	Ethyl 4-Oxo-7-(4-pyridyl)-1,4-dihydroquinoline-3-carboxylate
CAS:	40034-41-1
Synonyms:	4-oxo-7-pyridin-4-yl-1H-quinoline-3-carboxylic acid ethyl ester; ethyl 4-oxo-7-pyridin-4-yl-1H-quinoline-3-carboxylate

Technical Data

IUPAC Name:	ethyl 4-oxo-7-pyridin-4-yl-1H-quinoline-3-carboxylate
Description:	Ethyl 4-Oxo-7-(4-pyridyl)-1,4-dihydroquinoline-3-carboxylate (CAS# 40034-41-1 ) is a useful research chemical.
Molecular Weight:	294.30
Molecular Formula:	C17H14N2O3
Canonical SMILES:	CCOC(=O)C1=CNC2=C(C1=O)C=CC(=C2)C3=CC=NC=C3
InChI:	InChI=1S/C17H14N2O3/c1-2-22-17(21)14-10-19-15-9-12(3-4-13(15)16(14)20)11-5-7-18-8-6-11/h3-10H,2H2,1H3,(H,19,20)
InChI Key:	MZESMDMSRBNRBO-UHFFFAOYSA-N
Boiling Point:	469.8 °C at 760 mmHg
Density:	1.264 g/cm³
LogP:	2.76680

Publication Number	Title	Priority Date
US-4959363-A	Quinolonecarboxamide compounds, their preparation and use as antivirals.	19890623
US-3840544-A	Alkyl 4-alkoxy-7-(pyridyl)-3-quinoline-carboxylates,their preparation and conversion to corresponding 4-oxo compounds	19720619
US-3862154-A	4-chloro-7-(4-pyridyl)-3-quinolinecarboxylates	19720619
GB-1396681-A	Preparation of nitrophenylpyridines	19720612
US-3922278-A	4-(3-Nitrophenyl)-3,5-pyridinedicarboxylic acid	19720612

Complexity:	469
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	1
Defined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Exact Mass:	294.10044231
Formal Charge:	0
Heavy Atom Count:	22
Hydrogen Bond Acceptor Count:	5
Hydrogen Bond Donor Count:	1
Isotope Atom Count:	0
Monoisotopic Mass:	294.10044231
Rotatable Bond Count:	4
Topological Polar Surface Area:	68.3
Undefined Atom Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0
XLogP3:	2.5