Chemical ID: 4523544

Cc1ccc(cc1)NC(=O)c2cccc(c2)NC(=O)c3ccc(c(c3)[N+](=O)[O-])Br
Chemical ID:
4523544
Name [?]:
4-bromo-3-nitro-N-[3-(p-tolylcarbamoyl)phenyl]-benzamide
SMILES [?]:
Cc1ccc(cc1)NC(=O)c2cccc(c2)NC(=O)c3ccc(c(c3)[N+](=O)[O-])Br
InChi [?]:
None
InChi Info:
None

Chemical Details

Atom Count
Formula:C21H16BrN3O4
All Atoms:29
Heavy Atoms:29
Chiral Atoms:0
ZAP Information [?]
Total:6.45865
Area:626.208
Solvation:-9.19654
Coulombic:-53.3044
Bond Count [?]
All:31
Single:19
Double:12
Rotors:7
Chiral:0
Rigid Segments:6
Chemical Properties
Molecular Weight:454.274
H-Bond Donors:2
H-Bond Acceptors:7
XLogP:4.97
LogP (Chemaxon):5.37

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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