Chemical ID: 5987211

c1ccc(c(c1)c2cc(n(n2)c3ccc(cc3)F)C(=O)NC4CCCCC4)Cl
Chemical ID:
5987211
Name [?]:
5-(2-chlorophenyl)-N-cyclohexyl-2-(4-fluorophenyl)-pyrazole-3-carboxamide
SMILES [?]:
c1ccc(c(c1)c2cc(n(n2)c3ccc(cc3)F)C(=O)NC4CCCCC4)Cl
InChi [?]:
None
InChi Info:
None

Chemical Details

Atom Count
Formula:C22H21ClFN3O
All Atoms:28
Heavy Atoms:28
Chiral Atoms:0
ZAP Information [?]
Total:11.3249
Area:592.986
Solvation:-3.49972
Coulombic:-33.2351
Bond Count [?]
All:31
Single:22
Double:9
Rotors:5
Chiral:0
Rigid Segments:5
Chemical Properties
Molecular Weight:397.873
H-Bond Donors:1
H-Bond Acceptors:2
XLogP:6.05
LogP (Chemaxon):4.99

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