Chemical ID: 4600945

CCOc1ccc2ccccc2c1C=NNC(=O)CNC(=O)c3cccc(c3)Br
Chemical ID:
4600945
Name [?]:
3-bromo-N-[(2-ethoxy-1-naphthyl)methyleneaminocarbamoylmethyl]benzamide
SMILES [?]:
CCOc1ccc2ccccc2c1C=NNC(=O)CNC(=O)c3cccc(c3)Br
InChi [?]:
None
InChi Info:
None

Chemical Details

Atom Count
Formula:C22H20BrN3O3
All Atoms:29
Heavy Atoms:29
Chiral Atoms:0
ZAP Information [?]
Total:10.8223
Area:643.1
Solvation:-5.25517
Coulombic:-49.0696
Bond Count [?]
All:31
Single:20
Double:11
Rotors:9
Chiral:1
Rigid Segments:7
Chemical Properties
Molecular Weight:454.317
H-Bond Donors:2
H-Bond Acceptors:6
XLogP:5.57
LogP (Chemaxon):4.05

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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