Chemical ID: 4029793

CCOC(=O)C1CCCN(C1)S(=O)(=O)c2ccc(c(c2)Cl)F
Chemical ID:
4029793
Name [?]:
ethyl 1-(3-chloro-4-fluoro-phenyl)sulfonylpiperidine-3-carboxylate
SMILES [?]:
CCOC(=O)C1CCCN(C1)S(=O)(=O)c2ccc(c(c2)Cl)F
InChi [?]:
None
InChi Info:
None

Chemical Details

Atom Count
Formula:C14H17ClFNO4S
All Atoms:22
Heavy Atoms:22
Chiral Atoms:2
ZAP Information [?]
Total:9.07657
Area:519.787
Solvation:-3.91811
Coulombic:-28.6699
Bond Count [?]
All:23
Single:17
Double:6
Rotors:5
Chiral:0
Rigid Segments:5
Chemical Properties
Molecular Weight:349.806
H-Bond Donors:0
H-Bond Acceptors:5
XLogP:2.55
LogP (Chemaxon):2.4

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