Name: Name:4-(4-methylphenyl)-3-(1H-pyrrol-1-yl)thiophene-2-carboxylic acid
Brand: Angene
SKU: AG01BBW7
Rating: 90 (10 reviews)

4-(4-methylphenyl)-3-(1H-pyrrol-1-yl)thiophene-2-carboxylic acid

CAS No.:

1803608-58-3

Catalog Number:

AG01BBW7

Molecular Formula:

C16H13NO2S

Molecular Weight:

283.3449

Catalog Number:

AG01BBW7

Chemical Name:

4-(4-methylphenyl)-3-(1H-pyrrol-1-yl)thiophene-2-carboxylic acid

CAS Number:

1803608-58-3

Molecular Formula:

C16H13NO2S

Molecular Weight:

283.3449

MDL Number:

MFCD28714629

IUPAC Name:

4-(4-methylphenyl)-3-pyrrol-1-ylthiophene-2-carboxylic acid

InChI:

InChI=1S/C16H13NO2S/c1-11-4-6-12(7-5-11)13-10-20-15(16(18)19)14(13)17-8-2-3-9-17/h2-10H,1H3,(H,18,19)

InChI Key:

XLZCFFIHBLSZQB-UHFFFAOYSA-N

SMILES:

Cc1ccc(cc1)c1csc(c1n1cccc1)C(=O)O

Complexity:

348

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

283.067g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

283.345g/mol

Monoisotopic Mass:

283.067g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

70.5A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

3.9