Name: Name:4-(3-bromobenzamido)benzoic acid
Brand: Angene
SKU: AG019W0Q
Rating: 90 (10 reviews)

4-(3-bromobenzamido)benzoic acid

CAS No.:

413574-80-8

Catalog Number:

AG019W0Q

Molecular Formula:

C14H10BrNO3

Molecular Weight:

320.1381

Pack Size

Purity

Availability

Location

Price(USD)

Quantity

Product Description

Catalog Number:

AG019W0Q

Chemical Name:

4-(3-bromobenzamido)benzoic acid

CAS Number:

413574-80-8

Molecular Formula:

C14H10BrNO3

Molecular Weight:

320.1381

MDL Number:

MFCD00433572

IUPAC Name:

4-[(3-bromobenzoyl)amino]benzoic acid

InChI:

InChI=1S/C14H10BrNO3/c15-11-3-1-2-10(8-11)13(17)16-12-6-4-9(5-7-12)14(18)19/h1-8H,(H,16,17)(H,18,19)

InChI Key:

NDPSYYITQRRGHS-UHFFFAOYSA-N

SMILES:

Brc1cccc(c1)C(=O)Nc1ccc(cc1)C(=O)O

Properties

Complexity:

340

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

318.984g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

320.142g/mol

Monoisotopic Mass:

318.984g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

66.4A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

2.8

Literature

Title	Journal
Synthesis and SAR studies of 1,4-benzoxazine MenB inhibitors: novel antibacterial agents against Mycobacterium tuberculosis.	Bioorganic & medicinal chemistry letters 20101101