Chemical ID: 5844473

CCOc1cc(ccc1OC(=O)c2ccc(cc2)F)C=NNC(=O)Cc3ccccc3
Chemical ID:
5844473
Name [?]:
[2-ethoxy-4-[(2-phenylacetyl)aminoiminomethyl]phenyl] 4-fluorobenzoate
SMILES [?]:
CCOc1cc(ccc1OC(=O)c2ccc(cc2)F)C=NNC(=O)Cc3ccccc3
InChi [?]:
None
InChi Info:
None

Chemical Details

Atom Count
Formula:C24H21FN2O4
All Atoms:31
Heavy Atoms:31
Chiral Atoms:0
ZAP Information [?]
Total:9.99568
Area:667.032
Solvation:-6.68011
Coulombic:-49.9702
Bond Count [?]
All:33
Single:21
Double:12
Rotors:10
Chiral:1
Rigid Segments:7
Chemical Properties
Molecular Weight:420.433
H-Bond Donors:1
H-Bond Acceptors:6
XLogP:5.54
LogP (Chemaxon):4.82

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