CAS 735320-34-0 | 4-[(dimethyl-1,2-oxazol-4-yl)methoxy]-3-methoxybenzoic acid | CAS Number 735320-34-0

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735320-34-0 | 4-[(dimethyl-1,2-oxazol-4-yl)methoxy]-3-methoxybenzoic acid

CAS No: 735320-34-0 Catalog No: AG019IAM MDL No:MFCD03988204

Product Description

Catalog Number:

AG019IAM

Chemical Name:

4-[(dimethyl-1,2-oxazol-4-yl)methoxy]-3-methoxybenzoic acid

CAS Number:

735320-34-0

Molecular Formula:

C14H15NO5

Molecular Weight:

277.2726

MDL Number:

MFCD03988204

IUPAC Name:

4-[(3,5-dimethyl-1,2-oxazol-4-yl)methoxy]-3-methoxybenzoic acid

InChI:

InChI=1S/C14H15NO5/c1-8-11(9(2)20-15-8)7-19-12-5-4-10(14(16)17)6-13(12)18-3/h4-6H,7H2,1-3H3,(H,16,17)

InChI Key:

APEFXJUOGYEBEW-UHFFFAOYSA-N

SMILES:

COc1cc(ccc1OCc1c(C)noc1C)C(=O)O

Properties

Complexity:

338

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

277.095g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

277.276g/mol

Monoisotopic Mass:

277.095g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

81.8A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

2.1

Literature

Title	Journal
Synthesis and SAR studies of 1,4-benzoxazine MenB inhibitors: novel antibacterial agents against Mycobacterium tuberculosis.	Bioorganic & medicinal chemistry letters 20101101
Microsphere-based protease assays and screening application for lethal factor and factor Xa.	Cytometry. Part A : the journal of the International Society for Analytical Cytology 20060501