Chemical ID: 4385741

CC1CCN(CC1)S(=O)(=O)c2ccc(c(c2)C(=O)O)OC
Chemical ID:
4385741
Name [?]:
2-methoxy-5-[(4-methyl-1-piperidyl)sulfonyl]benzoic acid
SMILES [?]:
CC1CCN(CC1)S(=O)(=O)c2ccc(c(c2)C(=O)O)OC
InChi [?]:
None
InChi Info:
None

Chemical Details

Atom Count
Formula:C14H19NO5S
All Atoms:21
Heavy Atoms:21
Chiral Atoms:0
ZAP Information [?]
Total:7.50703
Area:478.512
Solvation:-4.45575
Coulombic:-40.3916
Bond Count [?]
All:22
Single:16
Double:6
Rotors:4
Chiral:0
Rigid Segments:5
Chemical Properties
Molecular Weight:313.37
H-Bond Donors:1
H-Bond Acceptors:6
XLogP:2.01
LogP (Chemaxon):1.49

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