2-Amino-4-morpholinobenzoic Acid - CAS 404010-74-8

Catalog:	BB024487
Product Name:	2-Amino-4-morpholinobenzoic Acid
CAS:	404010-74-8
Synonyms:	2-amino-4-(4-morpholinyl)benzoic acid; 2-amino-4-morpholin-4-ylbenzoic acid

Technical Data

Patents

Computed Properties

IUPAC Name:	2-amino-4-morpholin-4-ylbenzoic acid
Description:	2-Amino-4-morpholinobenzoic Acid (CAS# 404010-74-8) is used as reactant in the preparation of quinazoline analogs as orally active inhibitors of AP-1 and NF-kB mediated transcriptional activation.
Molecular Weight:	222.24
Molecular Formula:	C11H14N2O3
Canonical SMILES:	C1COCCN1C2=CC(=C(C=C2)C(=O)O)N
InChI:	InChI=1S/C11H14N2O3/c12-10-7-8(1-2-9(10)11(14)15)13-3-5-16-6-4-13/h1-2,7H,3-6,12H2,(H,14,15)
InChI Key:	VTRWQMUAQBUSQO-UHFFFAOYSA-N
LogP:	1.44980

Publication Number	Title	Priority Date
US-2020148634-A1	Acly inhibitors and uses thereof	20181109
WO-2020097408-A1	Acly inhibitors and uses thereof	20181109
WO-2020084491-A1	Inhibitors of human immunodeficiency virus replication	20181024
EP-3870576-A1	Inhibitors of human immunodeficiency virus replication	20181024
WO-2017050994-A1	Dye composition using at least one oxidation base and at least one particular aminobenzene coupler, processes and device	20150923

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Complexity:	254
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	1
Defined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Exact Mass:	222.10044231
Formal Charge:	0
Heavy Atom Count:	16
Hydrogen Bond Acceptor Count:	5
Hydrogen Bond Donor Count:	2
Isotope Atom Count:	0
Monoisotopic Mass:	222.10044231
Rotatable Bond Count:	2
Topological Polar Surface Area:	75.8
Undefined Atom Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0
XLogP3:	1.8