Chemical ID: 5793167

CCOc1cc(ccc1OC(=O)c2ccc(cc2)Br)C=NNC(=O)CNc3ccc(cc3)C
Chemical ID:
5793167
Name [?]:
[2-ethoxy-4-[[2-(p-tolylamino)acetyl]aminoiminomethyl]phenyl] 4-bromobenzoate
SMILES [?]:
CCOc1cc(ccc1OC(=O)c2ccc(cc2)Br)C=NNC(=O)CNc3ccc(cc3)C
InChi [?]:
None
InChi Info:
None

Chemical Details

Atom Count
Formula:C25H24BrN3O4
All Atoms:33
Heavy Atoms:33
Chiral Atoms:0
ZAP Information [?]
Total:12.6676
Area:741.41
Solvation:-5.86768
Coulombic:-58.8493
Bond Count [?]
All:35
Single:23
Double:12
Rotors:11
Chiral:1
Rigid Segments:8
Chemical Properties
Molecular Weight:510.38
H-Bond Donors:2
H-Bond Acceptors:7
XLogP:6.21
LogP (Chemaxon):5.42

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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