CID 47439911
PubChem CID
47439911
Structure
Molecular Formula
Status
Non-live
Molecular Weight
294.37 g/mol
Dates
- Create:2010-11-26
Chemical Structure Depiction
4-(cyclohex-3-en-1-ylmethylsulfamoyl)benzamide
InChI=1S/C14H18N2O3S/c15-14(17)12-6-8-13(9-7-12)20(18,19)16-10-11-4-2-1-3-5-11/h1-2,6-9,11,16H,3-5,10H2,(H2,15,17)
TVGWMWUAHMAYFF-UHFFFAOYSA-N
C1CC(CC=C1)CNS(=O)(=O)C2=CC=C(C=C2)C(=O)N
C14H18N2O3S
Property Name
Property Value
Reference
Property Name
Molecular Weight
Property Value
294.37 g/mol
Property Name
XLogP3-AA
Property Value
1.5
Property Name
Hydrogen Bond Donor Count
Property Value
2
Property Name
Hydrogen Bond Acceptor Count
Property Value
4
Property Name
Rotatable Bond Count
Property Value
5
Property Name
Exact Mass
Property Value
294.10381361 g/mol
Property Name
Monoisotopic Mass
Property Value
294.10381361 g/mol
Property Name
Topological Polar Surface Area
Property Value
97.6 A^2
Property Name
Heavy Atom Count
Property Value
20
Property Name
Formal Charge
Property Value
0
Property Name
Complexity
Property Value
459
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
1
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
CONTENTS