Chemical ID: 6001813

CCCCCCN(CC(=O)Nc1cc(on1)C)C(=O)c2ccccc2C
Chemical ID:
6001813
Name [?]:
N-hexyl-2-methyl-N-[(5-methylisoxazol-3-yl)carbamoylmethyl]benzamide
SMILES [?]:
CCCCCCN(CC(=O)Nc1cc(on1)C)C(=O)c2ccccc2C
InChi [?]:
None
InChi Info:
None

Chemical Details

Atom Count
Formula:C20H27N3O3
All Atoms:26
Heavy Atoms:26
Chiral Atoms:0
ZAP Information [?]
Total:11.5218
Area:605.723
Solvation:-3.62128
Coulombic:-43.5956
Bond Count [?]
All:27
Single:20
Double:7
Rotors:11
Chiral:0
Rigid Segments:7
Chemical Properties
Molecular Weight:357.447
H-Bond Donors:1
H-Bond Acceptors:4
XLogP:4.52
LogP (Chemaxon):3.96

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