Chemical ID: 5885291

CCCCCN(CC(=O)Nc1cc(nn1c2ccccc2Cl)C(C)(C)C)C(=O)c3ccc4ccccc4c3
Chemical ID:
5885291
Name [?]:
N-[[2-(2-chlorophenyl)-5-tert-butyl-pyrazol-3-yl]carbamoylmethyl]-N-pentyl-naphthalene-2-carboxamide
SMILES [?]:
CCCCCN(CC(=O)Nc1cc(nn1c2ccccc2Cl)C(C)(C)C)C(=O)c3ccc4ccccc4c3
InChi [?]:
None
InChi Info:
None

Chemical Details

Atom Count
Formula:C31H35ClN4O2
All Atoms:38
Heavy Atoms:38
Chiral Atoms:0
ZAP Information [?]
Total:16.0181
Area:802.4
Solvation:-4.04189
Coulombic:-47.1038
Bond Count [?]
All:41
Single:29
Double:12
Rotors:12
Chiral:0
Rigid Segments:9
Chemical Properties
Molecular Weight:531.088
H-Bond Donors:1
H-Bond Acceptors:4
XLogP:7.64
LogP (Chemaxon):7.32

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