4-(3-Bromopropyl)morpholin-3-one - CAS 1347548-91-7

Catalog:	BB008005
Product Name:	4-(3-Bromopropyl)morpholin-3-one
CAS:	1347548-91-7
Synonyms:	4-(3-bromopropyl)-3-morpholinone; 4-(3-bromopropyl)morpholin-3-one

Technical Data

Patents

Computed Properties

IUPAC Name:	4-(3-bromopropyl)morpholin-3-one
Description:	4-(3-Bromopropyl)morpholin-3-one (CAS# 1347548-91-7 ) is a useful research chemical.
Molecular Weight:	222.08
Molecular Formula:	C7H12BrNO2
Canonical SMILES:	C1COCC(=O)N1CCCBr
InChI:	InChI=1S/C7H12BrNO2/c8-2-1-3-9-4-5-11-6-7(9)10/h1-6H2
InChI Key:	FFNOMDCQQAEXTC-UHFFFAOYSA-N
LogP:	0.56810

Publication Number	Title	Priority Date
EP-3292120-A1	Tetrahydropyridopyrimidines and tetrahydropyridopyridines as inhibitors of hbsag (hbv surface antigen) and hbv dna production for the treatment of hepatitis b virus infections	20150504
EP-3292120-B1	Tetrahydropyridopyrimidines and tetrahydropyridopyridines as inhibitors of hbsag (hbv surface antigen) and hbv dna production for the treatment of hepatitis b virus infections	20150504
JP-2018514575-A	Tetrahydropyridopyrimidines and tetrahydropyridopyridines as inhibitors of HBsAg (HBV surface antigen) and HBV DNA production for the treatment of hepatitis B virus infection	20150504
JP-6462155-B2	Tetrahydropyridopyrimidines and tetrahydropyridopyridines as inhibitors of HBsAg (HBV surface antigen) and HBV DNA production for the treatment of hepatitis B virus infection	20150504
TW-201704233-A	Novel tetrahydropyridopyrimidine and tetrahydropyridinopyridine for the treatment and prevention of hepatitis B virus infection	20150504

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Complexity:	140
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	1
Defined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Exact Mass:	221.00514
Formal Charge:	0
Heavy Atom Count:	11
Hydrogen Bond Acceptor Count:	2
Hydrogen Bond Donor Count:	0
Isotope Atom Count:	0
Monoisotopic Mass:	221.00514
Rotatable Bond Count:	3
Topological Polar Surface Area:	29.5
Undefined Atom Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0
XLogP3:	0.5