Name: Name:2-(Benzoylamino)-5-ethylthiophene-3-carboxylic acid
Brand: Angene
SKU: AG005XY6
Rating: 90 (10 reviews)

2-(Benzoylamino)-5-ethylthiophene-3-carboxylic acid

CAS No.:

73696-46-5

Catalog Number:

AG005XY6

Molecular Formula:

C14H13NO3S

Molecular Weight:

275.3229

Pack Size

Purity

Availability

Location

Price(USD)

Quantity

95%

In Stock USA

United States

$96

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Product Description

Catalog Number:

AG005XY6

Chemical Name:

2-(Benzoylamino)-5-ethylthiophene-3-carboxylic acid

CAS Number:

73696-46-5

Molecular Formula:

C14H13NO3S

Molecular Weight:

275.3229

MDL Number:

MFCD01121931

IUPAC Name:

2-benzamido-5-ethylthiophene-3-carboxylic acid

InChI:

InChI=1S/C14H13NO3S/c1-2-10-8-11(14(17)18)13(19-10)15-12(16)9-6-4-3-5-7-9/h3-8H,2H2,1H3,(H,15,16)(H,17,18)

InChI Key:

YQSMKWKWMFBYGS-UHFFFAOYSA-N

SMILES:

CCc1cc(c(s1)NC(=O)c1ccccc1)C(=O)O

Properties

Complexity:

342

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

275.062g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

275.322g/mol

Monoisotopic Mass:

275.062g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

94.6A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

3.7

Literature

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