Chemical ID: 4129428

Cc1cccc(c1)C(=O)Oc2ccc(cc2)C=NNC(=O)COc3ccc(cc3)Cl
Chemical ID:
4129428
Name [?]:
[4-[[2-(4-chlorophenoxy)acetyl]aminoiminomethyl]phenyl] 3-methylbenzoate
SMILES [?]:
Cc1cccc(c1)C(=O)Oc2ccc(cc2)C=NNC(=O)COc3ccc(cc3)Cl
InChi [?]:
None
InChi Info:
None

Chemical Details

Atom Count
Formula:C23H19ClN2O4
All Atoms:30
Heavy Atoms:30
Chiral Atoms:0
ZAP Information [?]
Total:10.8835
Area:686.124
Solvation:-6.2696
Coulombic:-46.9746
Bond Count [?]
All:32
Single:20
Double:12
Rotors:9
Chiral:1
Rigid Segments:7
Chemical Properties
Molecular Weight:422.861
H-Bond Donors:1
H-Bond Acceptors:6
XLogP:6.24
LogP (Chemaxon):5.23

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