Chemical ID: 5984991

CCCN(CCC)C(=O)c1cc(nn1c2ccc(cc2)[N+](=O)[O-])c3ccc(c(c3)C)C
Chemical ID:
5984991
Name [?]:
5-(3,4-dimethylphenyl)-2-(4-nitrophenyl)-N,N-dipropyl-pyrazole-3-carboxamide
SMILES [?]:
CCCN(CCC)C(=O)c1cc(nn1c2ccc(cc2)[N+](=O)[O-])c3ccc(c(c3)C)C
InChi [?]:
None
InChi Info:
None

Chemical Details

Atom Count
Formula:C24H28N4O3
All Atoms:31
Heavy Atoms:31
Chiral Atoms:0
ZAP Information [?]
Total:9.15991
Area:654.959
Solvation:-7.21406
Coulombic:-36.8166
Bond Count [?]
All:33
Single:23
Double:10
Rotors:9
Chiral:0
Rigid Segments:8
Chemical Properties
Molecular Weight:420.504
H-Bond Donors:0
H-Bond Acceptors:5
XLogP:5.79
LogP (Chemaxon):5.5

Name Annotations

Note: All annotations are abbreviated. For more detailed information please download chemical.

ChemicalMix SourceExternal IDDescriptorValue

Experimental Annotations

Note: All annotations are abbreviated. For more detailed information please download chemical.

Chemical MixSourceExternal IDDescriptorValue

Descriptor Annotations

Note: All annotations are abbreviated. For more detailed information please download chemical.

Chemical MixSourceExternal IDDescriptorValue