Chemical ID: 4128333

c1ccc(c(c1)C=NNC(=O)c2ccncc2)OC(=O)c3ccc(cc3)Cl
Chemical ID:
4128333
Name [?]:
[2-(4-pyridylcarbonylaminoiminomethyl)phenyl] 4-chlorobenzoate
SMILES [?]:
c1ccc(c(c1)C=NNC(=O)c2ccncc2)OC(=O)c3ccc(cc3)Cl
InChi [?]:
None
InChi Info:
None

Chemical Details

Atom Count
Formula:C20H14ClN3O3
All Atoms:27
Heavy Atoms:27
Chiral Atoms:0
ZAP Information [?]
Total:10.9545
Area:597.177
Solvation:-3.97495
Coulombic:-45.3061
Bond Count [?]
All:29
Single:17
Double:12
Rotors:7
Chiral:1
Rigid Segments:6
Chemical Properties
Molecular Weight:379.796
H-Bond Donors:1
H-Bond Acceptors:5
XLogP:4.87
LogP (Chemaxon):3.68

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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