Chemical ID: 5856645

CC(C)C(C(=O)NN=Cc1ccc(c(c1)[N+](=O)[O-])N(C)C)NC(=O)c2ccccc2Cl
Chemical ID:
5856645
Name [?]:
2-chloro-N-[1-[(4-dimethylamino-3-nitro-phenyl)methyleneaminocarbamoyl]-2-methyl-propyl]-benzamide
SMILES [?]:
CC(C)C(C(=O)NN=Cc1ccc(c(c1)[N+](=O)[O-])N(C)C)NC(=O)c2ccccc2Cl
InChi [?]:
None
InChi Info:
None

Chemical Details

Atom Count
Formula:C21H24ClN5O4
All Atoms:31
Heavy Atoms:31
Chiral Atoms:1
ZAP Information [?]
Total:5.43344
Area:668.912
Solvation:-11.2894
Coulombic:-57.9422
Bond Count [?]
All:32
Single:22
Double:10
Rotors:10
Chiral:1
Rigid Segments:9
Chemical Properties
Molecular Weight:445.899
H-Bond Donors:2
H-Bond Acceptors:9
XLogP:4.95
LogP (Chemaxon):4.31

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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