Chemical ID: 5873673

COc1ccc(cc1OC)CCN(Cc2ccc(cc2)F)S(=O)(=O)c3cccc(c3)C(F)(F)F
Chemical ID:
5873673
Name [?]:
N-[2-(3,4-dimethoxyphenyl)ethyl]-N-[(4-fluorophenyl)methyl]-3-(trifluoromethyl)benzenesulfonamide
SMILES [?]:
COc1ccc(cc1OC)CCN(Cc2ccc(cc2)F)S(=O)(=O)c3cccc(c3)C(F)(F)F
InChi [?]:
None
InChi Info:
None

Chemical Details

Atom Count
Formula:C24H23F4NO4S
All Atoms:34
Heavy Atoms:34
Chiral Atoms:1
ZAP Information [?]
Total:9.06805
Area:677.439
Solvation:-7.86792
Coulombic:-45.0551
Bond Count [?]
All:36
Single:25
Double:11
Rotors:10
Chiral:0
Rigid Segments:8
Chemical Properties
Molecular Weight:497.503
H-Bond Donors:0
H-Bond Acceptors:5
XLogP:5.34
LogP (Chemaxon):5.49

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