Chemical ID: 5774872

c1ccc(c(c1)C=NNC(=O)C2CCCN2C(=O)c3ccc(cc3)[N+](=O)[O-])Cl
Chemical ID:
5774872
Name [?]:
N-[(2-chlorophenyl)methyleneamino]-1-(4-nitrobenzoyl)-pyrrolidine-2-carboxamide
SMILES [?]:
c1ccc(c(c1)C=NNC(=O)C2CCCN2C(=O)c3ccc(cc3)[N+](=O)[O-])Cl
InChi [?]:
None
InChi Info:
None

Chemical Details

Atom Count
Formula:C19H17ClN4O4
All Atoms:28
Heavy Atoms:28
Chiral Atoms:1
ZAP Information [?]
Total:4.85475
Area:601.788
Solvation:-10.19
Coulombic:-47.7412
Bond Count [?]
All:30
Single:20
Double:10
Rotors:7
Chiral:1
Rigid Segments:7
Chemical Properties
Molecular Weight:400.816
H-Bond Donors:1
H-Bond Acceptors:8
XLogP:4.31
LogP (Chemaxon):3.41

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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