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methyl 5-chlorobenzo[c]2,6-naphthyridine-8-carboxylate

methyl 5-chlorobenzo[c]2,6-naphthyridine-8-carboxylate - CAS 1009826-84-9

Catalog:	BB000409
Product Name:	methyl 5-chlorobenzo[c]2,6-naphthyridine-8-carboxylate
CAS:	1009826-84-9
Synonyms:	5-chloro-8-benzo[c][2,6]naphthyridinecarboxylic acid methyl ester; methyl 5-chlorobenzo[c][2,6]naphthyridine-8-carboxylate

Technical Data

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Computed Properties

IUPAC Name:	methyl 5-chlorobenzo[c][2,6]naphthyridine-8-carboxylate
Description:	methyl 5-chlorobenzo[c]2,6-naphthyridine-8-carboxylate (CAS# 1009826-84-9 ) is a useful research chemical.
Molecular Weight:	272.688
Molecular Formula:	C14H9ClN2O2
Canonical SMILES:	COC(=O)C1=CC2=NC(=C3C=CN=CC3=C2C=C1)Cl
InChI:	InChI=1S/C14H9ClN2O2/c1-19-14(18)8-2-3-9-11-7-16-5-4-10(11)13(15)17-12(9)6-8/h2-7H,1H3
InChI Key:	XCRKEOCRHSQXHV-UHFFFAOYSA-N
LogP:	3.22300

Publication Number	Title	Priority Date
US-2019231759-A1	Therapeutic targeting of proteolytic cleavage of the mixed lineage leukemia gene product (mll1) by taspase1 using kinase inhibitors	20180126
US-2012129849-A1	Deuterated serine-threonine protein kinase modulators	20101022
WO-2012054493-A1	Deuterated serine-threonine protein kinase modulators	20101022
US-2011160240-A1	Polymorphs and salts of a kinase inhibitor	20091123
US-8853235-B2	Polymorphs and salts of a kinase inhibitor	20091123

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Complexity:	352
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	1
Defined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Exact Mass:	272.0352552
Formal Charge:	0
Heavy Atom Count:	19
Hydrogen Bond Acceptor Count:	4
Hydrogen Bond Donor Count:	0
Isotope Atom Count:	0
Monoisotopic Mass:	272.0352552
Rotatable Bond Count:	2
Topological Polar Surface Area:	52.1
Undefined Atom Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0
XLogP3:	3.2