Chemical ID: 5794958

COc1cc(ccc1OC(=O)c2ccccc2)C=NNC(=O)Cc3ccc(c4c3cccc4)Br
Chemical ID:
5794958
Name [?]:
[4-[[2-(4-bromo-1-naphthyl)acetyl]aminoiminomethyl]-2-methoxy-phenyl] benzoate
SMILES [?]:
COc1cc(ccc1OC(=O)c2ccccc2)C=NNC(=O)Cc3ccc(c4c3cccc4)Br
InChi [?]:
None
InChi Info:
None

Chemical Details

Atom Count
Formula:C27H21BrN2O4
All Atoms:34
Heavy Atoms:34
Chiral Atoms:0
ZAP Information [?]
Total:11.742
Area:711.513
Solvation:-6.04577
Coulombic:-47.6908
Bond Count [?]
All:37
Single:23
Double:14
Rotors:9
Chiral:1
Rigid Segments:7
Chemical Properties
Molecular Weight:517.371
H-Bond Donors:1
H-Bond Acceptors:6
XLogP:7.02
LogP (Chemaxon):6.13

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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