Chemical ID: 4491389

Cc1ccc(cc1S(=O)(=O)NCC2CCCO2)C(=O)O
Chemical ID:
4491389
Name [?]:
4-methyl-3-(tetrahydrofuran-2-ylmethylsulfamoyl)benzoic acid
SMILES [?]:
Cc1ccc(cc1S(=O)(=O)NCC2CCCO2)C(=O)O
InChi [?]:
None
InChi Info:
None

Chemical Details

Atom Count
Formula:C13H17NO5S
All Atoms:20
Heavy Atoms:20
Chiral Atoms:1
ZAP Information [?]
Total:8.02439
Area:476.956
Solvation:-3.8995
Coulombic:-47.2
Bond Count [?]
All:21
Single:15
Double:6
Rotors:5
Chiral:0
Rigid Segments:5
Chemical Properties
Molecular Weight:299.344
H-Bond Donors:2
H-Bond Acceptors:6
XLogP:1.07
LogP (Chemaxon):1.14

Name Annotations

Note: All annotations are abbreviated. For more detailed information please download chemical.

ChemicalMix SourceExternal IDDescriptorValue

Experimental Annotations

Note: All annotations are abbreviated. For more detailed information please download chemical.

Chemical MixSourceExternal IDDescriptorValue

Descriptor Annotations

Note: All annotations are abbreviated. For more detailed information please download chemical.

Chemical MixSourceExternal IDDescriptorValue