Name: Name:Benzenamine, 4-[(difluoromethyl)sulfonyl]-
Brand: Angene
SKU: AG002PTL
Rating: 90 (10 reviews)

Benzenamine, 4-[(difluoromethyl)sulfonyl]-

CAS No.:

24906-77-2

Catalog Number:

AG002PTL

Molecular Formula:

C7H7F2NO2S

Molecular Weight:

207.1978

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Product Description

Catalog Number:

AG002PTL

Chemical Name:

Benzenamine, 4-[(difluoromethyl)sulfonyl]-

CAS Number:

24906-77-2

Molecular Formula:

C7H7F2NO2S

Molecular Weight:

207.1978

MDL Number:

MFCD00182675

IUPAC Name:

4-(difluoromethylsulfonyl)aniline

InChI:

InChI=1S/C7H7F2NO2S/c8-7(9)13(11,12)6-3-1-5(10)2-4-6/h1-4,7H,10H2

InChI Key:

OHQOPPCSAGDCDO-UHFFFAOYSA-N

SMILES:

FC(S(=O)(=O)c1ccc(cc1)N)F

Properties

Complexity:

252

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

207.017g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

207.195g/mol

Monoisotopic Mass:

207.017g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

68.5A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

0.8

Literature

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

Properties