Chemical ID: 5095349

COc1ccc(cc1c2cscn2)F
Chemical ID:
5095349
Name [?]:
4-(5-fluoro-2-methoxy-phenyl)thiazole
SMILES [?]:
COc1ccc(cc1c2cscn2)F
InChi [?]:
InChI=1/C10H8FNOS/c1-13-10-3-2-7(11)4-8(10)9-5-14-6-12-9/h2-6H,1H3
InChi Info:
AuxInfo=1/0/N:1,5,4,7,10,12,6,8,9,3,14,13,2,11/rA:14nCOCCCCCCCCSCNF/rB:s1;s2;s3;d4;s5;d6;d3s7;s8;d9;s10;s11;s9d12;s6;/rC:;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C10H8FNOS
All Atoms:14
Heavy Atoms:14
Chiral Atoms:0
ZAP Information [?]
Total:4.98888
Area:353.321
Solvation:-3.84414
Coulombic:-14.8257
Bond Count [?]
All:15
Single:10
Double:5
Rotors:2
Chiral:0
Rigid Segments:3
Chemical Properties
Molecular Weight:209.241
H-Bond Donors:0
H-Bond Acceptors:1
XLogP:2.94
LogP (Chemaxon):2.37

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