Chemical ID: 6415573

c1ccc(c(c1)C#N)OCC(=O)NN=Cc2cc(ccc2OC(=O)c3ccccc3Cl)Br
Chemical ID:
6415573
Name [?]:
[4-bromo-2-[[2-(2-cyanophenoxy)acetyl]aminoiminomethyl]phenyl] 2-chlorobenzoate
SMILES [?]:
c1ccc(c(c1)C#N)OCC(=O)NN=Cc2cc(ccc2OC(=O)c3ccccc3Cl)Br
InChi [?]:
None
InChi Info:
None

Chemical Details

Atom Count
Formula:C23H15BrClN3O4
All Atoms:32
Heavy Atoms:32
Chiral Atoms:0
ZAP Information [?]
Total:10.8365
Area:699.964
Solvation:-6.66265
Coulombic:-49.9686
Bond Count [?]
All:34
Single:21
Double:12
Rotors:9
Chiral:1
Rigid Segments:7
Chemical Properties
Molecular Weight:512.74
H-Bond Donors:1
H-Bond Acceptors:7
XLogP:6.32
LogP (Chemaxon):5.37

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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