Chemical ID: 4909225

c1ccn(c(=S)c1)O
Chemical ID:
4909225
Name [?]:
1-hydroxypyridine-2-thione
SMILES [?]:
c1ccn(c(=S)c1)O
InChi [?]:
InChI=1/C5H5NOS/c7-6-4-2-1-3-5(6)8/h1-4,7H
InChi Info:
AuxInfo=1/0/N:1,2,7,3,5,4,8,6/rA:8nCCCNCSCO/rB:s1;d2;s3;s4;d5;d1s5;s4;/rC:;;;;;;;;

Chemical Details

Atom Count
Formula:C5H5NOS
All Atoms:8
Heavy Atoms:8
Chiral Atoms:0
ZAP Information [?]
Total:4.88282
Area:266.0
Solvation:-1.7672
Coulombic:-15.4812
Bond Count [?]
All:8
Single:5
Double:3
Rotors:0
Chiral:0
Rigid Segments:1
Chemical Properties
Molecular Weight:127.165
H-Bond Donors:1
H-Bond Acceptors:1
XLogP:-0.3
LogP (Chemaxon):0.53

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