Chemical ID: 3952317

COCCNC(=S)N1CCC(CC1)c2nc(no2)c3ccc(cc3)F
Chemical ID:
3952317
Name [?]:
4-[3-(4-fluorophenyl)-1,2,4-oxadiazol-5-yl]-N-(2-methoxyethyl)piperidine-1-carbothioamide
SMILES [?]:
COCCNC(=S)N1CCC(CC1)c2nc(no2)c3ccc(cc3)F
InChi [?]:
None
InChi Info:
None

Chemical Details

Atom Count
Formula:C17H21FN4O2S
All Atoms:25
Heavy Atoms:25
Chiral Atoms:0
ZAP Information [?]
Total:9.99557
Area:583.202
Solvation:-4.58448
Coulombic:-42.7383
Bond Count [?]
All:27
Single:21
Double:6
Rotors:7
Chiral:0
Rigid Segments:6
Chemical Properties
Molecular Weight:364.439
H-Bond Donors:1
H-Bond Acceptors:3
XLogP:3.04
LogP (Chemaxon):2.43

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