Chemical ID: 6422797

c1cc(cnc1)c2cccs2
Chemical ID:
6422797
Name [?]:
3-(2-thienyl)pyridine
SMILES [?]:
c1cc(cnc1)c2cccs2
InChi [?]:
InChI=1/C9H7NS/c1-3-8(7-10-5-1)9-4-2-6-11-9/h1-7H
InChi Info:
AuxInfo=1/0/N:1,9,2,8,6,10,4,3,7,5,11/rA:11nCCCCNCCCCCS/rB:s1;d2;s3;d4;d1s5;s3;d7;s8;d9;s7s10;/rC:;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C9H7NS
All Atoms:11
Heavy Atoms:11
Chiral Atoms:0
ZAP Information [?]
Total:6.60454
Area:319.443
Solvation:-1.38154
Coulombic:-6.29389
Bond Count [?]
All:12
Single:7
Double:5
Rotors:1
Chiral:0
Rigid Segments:2
Chemical Properties
Molecular Weight:161.225
H-Bond Donors:0
H-Bond Acceptors:0
XLogP:1.74
LogP (Chemaxon):1.83

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