CID 29099103
PubChem CID
29099103
Structure
Molecular Formula
Status
Non-live
Molecular Weight
437.5 g/mol
Dates
- Create:2009-05-28
Chemical Structure Depiction
(2,5-difluorophenyl)sulfonyl-[3-[methyl(phenyl)sulfamoyl]phenyl]azanide
InChI=1S/C19H15F2N2O4S2/c1-23(16-7-3-2-4-8-16)29(26,27)17-9-5-6-15(13-17)22-28(24,25)19-12-14(20)10-11-18(19)21/h2-13H,1H3/q-1
UHAXYQSNIRUHBE-UHFFFAOYSA-N
CN(C1=CC=CC=C1)S(=O)(=O)C2=CC=CC(=C2)[N-]S(=O)(=O)C3=C(C=CC(=C3)F)F
C19H15F2N2O4S2-
Property Name
Property Value
Reference
Property Name
Molecular Weight
Property Value
437.5 g/mol
Property Name
XLogP3-AA
Property Value
3.4
Property Name
Hydrogen Bond Donor Count
Property Value
0
Property Name
Hydrogen Bond Acceptor Count
Property Value
8
Property Name
Rotatable Bond Count
Property Value
6
Property Name
Exact Mass
Property Value
437.04413064 g/mol
Property Name
Monoisotopic Mass
Property Value
437.04413064 g/mol
Property Name
Topological Polar Surface Area
Property Value
89.3 A^2
Property Name
Heavy Atom Count
Property Value
29
Property Name
Formal Charge
Property Value
-1
Property Name
Complexity
Property Value
745
Property Name
Isotope Atom Count
Property Value
0
Property Name
Defined Atom Stereocenter Count
Property Value
0
Property Name
Undefined Atom Stereocenter Count
Property Value
0
Property Name
Defined Bond Stereocenter Count
Property Value
0
Property Name
Undefined Bond Stereocenter Count
Property Value
0
Property Name
Covalently-Bonded Unit Count
Property Value
1
Property Name
Compound Is Canonicalized
Property Value
Yes
Old substance
Old substance
Old substance
Old substance
CONTENTS