Name: Name:4-[(3-ethylphenyl)sulfamoyl]-1H-pyrrole-2-carboxylic acid
Brand: Angene
SKU: AG01AHW1
Rating: 90 (10 reviews)

4-[(3-ethylphenyl)sulfamoyl]-1H-pyrrole-2-carboxylic acid

CAS No.:

937624-93-6

Catalog Number:

AG01AHW1

Molecular Formula:

C13H14N2O4S

Molecular Weight:

294.3263

Catalog Number:

AG01AHW1

Chemical Name:

4-[(3-ethylphenyl)sulfamoyl]-1H-pyrrole-2-carboxylic acid

CAS Number:

937624-93-6

Molecular Formula:

C13H14N2O4S

Molecular Weight:

294.3263

MDL Number:

MFCD09052809

IUPAC Name:

4-[(3-ethylphenyl)sulfamoyl]-1H-pyrrole-2-carboxylic acid

InChI:

InChI=1S/C13H14N2O4S/c1-2-9-4-3-5-10(6-9)15-20(18,19)11-7-12(13(16)17)14-8-11/h3-8,14-15H,2H2,1H3,(H,16,17)

InChI Key:

QBTNFJXSRUYJHD-UHFFFAOYSA-N

SMILES:

CCc1cccc(c1)NS(=O)(=O)c1c[nH]c(c1)C(=O)O

Complexity:

446

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

294.067g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

294.325g/mol

Monoisotopic Mass:

294.067g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

108A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

1.9