Chemical ID: 5794896

CCOc1cc(ccc1OC(=O)c2ccc(cc2)Br)C=NNC(=O)COc3cccc(c3)C
Chemical ID:
5794896
Name [?]:
[2-ethoxy-4-[[2-(3-methylphenoxy)acetyl]aminoiminomethyl]phenyl] 4-bromobenzoate
SMILES [?]:
CCOc1cc(ccc1OC(=O)c2ccc(cc2)Br)C=NNC(=O)COc3cccc(c3)C
InChi [?]:
None
InChi Info:
None

Chemical Details

Atom Count
Formula:C25H23BrN2O5
All Atoms:33
Heavy Atoms:33
Chiral Atoms:0
ZAP Information [?]
Total:11.0823
Area:736.292
Solvation:-7.32499
Coulombic:-54.1275
Bond Count [?]
All:35
Single:23
Double:12
Rotors:11
Chiral:1
Rigid Segments:8
Chemical Properties
Molecular Weight:511.365
H-Bond Donors:1
H-Bond Acceptors:7
XLogP:6.48
LogP (Chemaxon):5.59

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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