Name: Name:Benzoic acid, 3-[[(2,6-difluorophenyl)sulfonyl]amino]-2-fluoro-, methyl ester
Brand: Angene
SKU: AG000IYO
Rating: 90 (10 reviews)

Benzoic acid, 3-[[(2,6-difluorophenyl)sulfonyl]amino]-2-fluoro-, methyl ester

CAS No.:

1195768-19-4

Catalog Number:

AG000IYO

Molecular Formula:

C14H10F3NO4S

Molecular Weight:

345.2937

Catalog Number:

AG000IYO

Chemical Name:

Benzoic acid, 3-[[(2,6-difluorophenyl)sulfonyl]amino]-2-fluoro-, methyl ester

CAS Number:

1195768-19-4

Molecular Formula:

C14H10F3NO4S

Molecular Weight:

345.2937

MDL Number:

MFCD18447698

IUPAC Name:

methyl 3-[(2,6-difluorophenyl)sulfonylamino]-2-fluorobenzoate

InChI:

InChI=1S/C14H10F3NO4S/c1-22-14(19)8-4-2-7-11(12(8)17)18-23(20,21)13-9(15)5-3-6-10(13)16/h2-7,18H,1H3

InChI Key:

COSCWKICERLCEK-UHFFFAOYSA-N

SMILES:

COC(=O)c1cccc(c1F)NS(=O)(=O)c1c(F)cccc1F

EC Number:

812-675-6

Complexity:

515

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

345.028g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

345.292g/mol

Monoisotopic Mass:

345.028g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

80.8A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

2.6