CID 29767800
PubChem CID
29767800
Structure
Molecular Formula
Status
Non-live
Molecular Weight
298.40 g/mol
Dates
- Create:2009-05-28
Chemical Structure Depiction
5-amino-2-methoxy-N-[(1R,2S)-2-methylcyclohexyl]benzenesulfonamide
InChI=1S/C14H22N2O3S/c1-10-5-3-4-6-12(10)16-20(17,18)14-9-11(15)7-8-13(14)19-2/h7-10,12,16H,3-6,15H2,1-2H3/t10-,12+/m0/s1
RWBOMRUBFCMMTQ-CMPLNLGQSA-N
C[C@H]1CCCC[C@H]1NS(=O)(=O)C2=C(C=CC(=C2)N)OC
C14H22N2O3S
Property Name
Property Value
Reference
Property Name
Molecular Weight
Property Value
298.40 g/mol
Property Name
XLogP3-AA
Property Value
2.4
Property Name
Hydrogen Bond Donor Count
Property Value
2
Property Name
Hydrogen Bond Acceptor Count
Property Value
5
Property Name
Rotatable Bond Count
Property Value
4
Property Name
Exact Mass
Property Value
298.13511374 g/mol
Property Name
Monoisotopic Mass
Property Value
298.13511374 g/mol
Property Name
Topological Polar Surface Area
Property Value
89.8 A^2
Property Name
Heavy Atom Count
Property Value
20
Property Name
Formal Charge
Property Value
0
Property Name
Complexity
Property Value
407
Property Name
Isotope Atom Count
Property Value
0
Property Name
Defined Atom Stereocenter Count
Property Value
2
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
CONTENTS