Name: Name:2-Thiophenecarboxylicacid, 3-[[(4-chloro-3-Methyl-5-isoxazolyl)aMino]sulfonyl]-
Brand: Angene
SKU: AG00ABHI
Rating: 90 (10 reviews)

2-Thiophenecarboxylicacid, 3-[[(4-chloro-3-Methyl-5-isoxazolyl)aMino]sulfonyl]-

CAS No.:

184040-74-2

Catalog Number:

AG00ABHI

Molecular Formula:

C9H7ClN2O5S2

Molecular Weight:

322.7453

Catalog Number:

AG00ABHI

Chemical Name:

2-Thiophenecarboxylicacid, 3-[[(4-chloro-3-Methyl-5-isoxazolyl)aMino]sulfonyl]-

CAS Number:

184040-74-2

Molecular Formula:

C9H7ClN2O5S2

Molecular Weight:

322.7453

MDL Number:

MFCD18642943

IUPAC Name:

3-[(4-chloro-3-methyl-1,2-oxazol-5-yl)sulfamoyl]thiophene-2-carboxylic acid

InChI:

InChI=1S/C9H7ClN2O5S2/c1-4-6(10)8(17-11-4)12-19(15,16)5-2-3-18-7(5)9(13)14/h2-3,12H,1H3,(H,13,14)

InChI Key:

BFHXYQAPYRDEDW-UHFFFAOYSA-N

SMILES:

OC(=O)c1sccc1S(=O)(=O)Nc1onc(c1Cl)C

EC Number:

606-015-4

Complexity:

454

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

321.948g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

322.734g/mol

Monoisotopic Mass:

321.948g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

146A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

1.8