Chemical ID: 5892139

c1cc(c(cc1C(=O)Nc2ccc(c(c2)C(=O)NCC3CCCO3)N4CCCCC4)[N+](=O)[O-])Cl
Chemical ID:
5892139
Name [?]:
4-chloro-3-nitro-N-[4-(1-piperidyl)-3-(tetrahydrofuran-2-ylmethylcarbamoyl)phenyl]-benzamide
SMILES [?]:
c1cc(c(cc1C(=O)Nc2ccc(c(c2)C(=O)NCC3CCCO3)N4CCCCC4)[N+](=O)[O-])Cl
InChi [?]:
None
InChi Info:
None

Chemical Details

Atom Count
Formula:C24H27ClN4O5
All Atoms:34
Heavy Atoms:34
Chiral Atoms:1
ZAP Information [?]
Total:6.7283
Area:723.754
Solvation:-11.3655
Coulombic:-65.4207
Bond Count [?]
All:37
Single:28
Double:9
Rotors:9
Chiral:0
Rigid Segments:8
Chemical Properties
Molecular Weight:486.948
H-Bond Donors:2
H-Bond Acceptors:9
XLogP:4.21
LogP (Chemaxon):3.69

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