Chemical ID: 5996687

COc1ccc(cc1)c2nc(on2)C3CCCN3C(=O)CCC4CCCC4
Chemical ID:
5996687
Name [?]:
3-cyclopentyl-1-[2-[3-(4-methoxyphenyl)-1,2,4-oxadiazol-5-yl]pyrrolidin-1-yl]-propan-1-one
SMILES [?]:
COc1ccc(cc1)c2nc(on2)C3CCCN3C(=O)CCC4CCCC4
InChi [?]:
None
InChi Info:
None

Chemical Details

Atom Count
Formula:C21H27N3O3
All Atoms:27
Heavy Atoms:27
Chiral Atoms:1
ZAP Information [?]
Total:11.1647
Area:608.507
Solvation:-4.04797
Coulombic:-36.3325
Bond Count [?]
All:30
Single:24
Double:6
Rotors:7
Chiral:0
Rigid Segments:7
Chemical Properties
Molecular Weight:369.457
H-Bond Donors:0
H-Bond Acceptors:3
XLogP:4.92
LogP (Chemaxon):3.54

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