CID 30286656
PubChem CID
30286656
Structure
Molecular Formula
Status
Non-live
Molecular Weight
363.8 g/mol
Dates
- Create:2009-05-28
Chemical Structure Depiction
(3-chloro-2-fluorophenyl)-(3-sulfamoylphenyl)sulfonylazanide
InChI=1S/C12H9ClFN2O4S2/c13-10-5-2-6-11(12(10)14)16-22(19,20)9-4-1-3-8(7-9)21(15,17)18/h1-7H,(H2,15,17,18)/q-1
KXNAXIZEBFPJCS-UHFFFAOYSA-N
C1=CC(=CC(=C1)S(=O)(=O)[N-]C2=C(C(=CC=C2)Cl)F)S(=O)(=O)N
C12H9ClFN2O4S2-
Property Name
Property Value
Reference
Property Name
Molecular Weight
Property Value
363.8 g/mol
Property Name
XLogP3-AA
Property Value
1.7
Property Name
Hydrogen Bond Donor Count
Property Value
1
Property Name
Hydrogen Bond Acceptor Count
Property Value
7
Property Name
Rotatable Bond Count
Property Value
4
Property Name
Exact Mass
Property Value
362.9676300 g/mol
Property Name
Monoisotopic Mass
Property Value
362.9676300 g/mol
Property Name
Topological Polar Surface Area
Property Value
112 A^2
Property Name
Heavy Atom Count
Property Value
22
Property Name
Formal Charge
Property Value
-1
Property Name
Complexity
Property Value
587
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
CONTENTS