TLR2-IN-C29 50mg

CAT: 0628-A17160-50Size: 50 mgDry Ice: NoHazardous: No

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CAT#:0628-A17160-50Size:50 mg

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CAS Number

363600-92-4

Chemical Information

3-((2-Hydroxy-3-methoxybenzylidene)amino)-2-methylbenzoic acid

CAS Number	363600-92-4
PubChem CID	3579893
IUPAC Name	3-[(2-hydroxy-3-methoxyphenyl)methylideneamino]-2-methylbenzoic acid
Molecular Formula	C16H15NO4
Molecular Weight	285.29
XLogP	2.7
Topological Polar Surface Area	79.1
Hydrogen Bond Donor Count	2
Hydrogen Bond Acceptor Count	5
Rotatable Bond Count	4
Heavy Atom Count	21
Formal Charge	0
Complexity	384

SMILES

CC1=C(C=CC=C1N=CC2=C(C(=CC=C2)OC)O)C(=O)O

InChI

InChI=1S/C16H15NO4/c1-10-12(16(19)20)6-4-7-13(10)17-9-11-5-3-8-14(21-2)15(11)18/h3-9,18H,1-2H3,(H,19,20)

InChIKey

WTGMGRFVBFDHGQ-UHFFFAOYSA-N

Chemical Structure

2D Structure

CAS: 363600-92-4

CID: 3579893

Formula: C16H15NO4

MW: 285.29

Interactive 3D Structure

Loading 3D structure...

Computed Properties

Property	Value
Molecular Weight	285.29
XLogP3	2.7
Hydrogen Bond Donor Count	2
Hydrogen Bond Acceptor Count	5
Rotatable Bond Count	4
Exact Mass	285.10010796
Monoisotopic Mass	285.10010796
Topological Polar Surface Area	79.1 Å²
Heavy Atom Count	21
Formal Charge	0
Complexity	384
Isotope Atom Count	0
Defined Atom Stereocenter Count	0
Undefined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Undefined Bond Stereocenter Count	0
Covalently-Bonded Unit Count	1
Compound Is Canonicalized	Yes

Catalog	Name
562353	TLR2-IN-C29
BA6282-5.1	C29