Chemical ID: 6631333

CCCOc1ccc(cc1)C(=O)Oc2ccc(cc2)C=NNC(=O)COc3ccc(cc3)Cl
Chemical ID:
6631333
Name [?]:
[4-[[2-(4-chlorophenoxy)acetyl]aminoiminomethyl]phenyl] 4-propoxybenzoate
SMILES [?]:
CCCOc1ccc(cc1)C(=O)Oc2ccc(cc2)C=NNC(=O)COc3ccc(cc3)Cl
InChi [?]:
None
InChi Info:
None

Chemical Details

Atom Count
Formula:C25H23ClN2O5
All Atoms:33
Heavy Atoms:33
Chiral Atoms:0
ZAP Information [?]
Total:11.3693
Area:756.652
Solvation:-7.54704
Coulombic:-53.8839
Bond Count [?]
All:35
Single:23
Double:12
Rotors:12
Chiral:1
Rigid Segments:9
Chemical Properties
Molecular Weight:466.913
H-Bond Donors:1
H-Bond Acceptors:7
XLogP:6.5
LogP (Chemaxon):5.32

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