Chemical ID: 5859727

CC(C)C(C(=O)NN=Cc1cccc(c1)[N+](=O)[O-])NC(=O)c2ccc(cc2)Cl
Chemical ID:
5859727
Name [?]:
4-chloro-N-[2-methyl-1-[(3-nitrophenyl)methyleneaminocarbamoyl]propyl]-benzamide
SMILES [?]:
CC(C)C(C(=O)NN=Cc1cccc(c1)[N+](=O)[O-])NC(=O)c2ccc(cc2)Cl
InChi [?]:
None
InChi Info:
None

Chemical Details

Atom Count
Formula:C19H19ClN4O4
All Atoms:28
Heavy Atoms:28
Chiral Atoms:1
ZAP Information [?]
Total:6.50154
Area:634.099
Solvation:-9.35093
Coulombic:-53.7608
Bond Count [?]
All:29
Single:19
Double:10
Rotors:9
Chiral:1
Rigid Segments:8
Chemical Properties
Molecular Weight:402.831
H-Bond Donors:2
H-Bond Acceptors:8
XLogP:4.74
LogP (Chemaxon):4.05

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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