Chemical ID: 7243946

c1cc(ccc1c2nc(cs2)CC(=O)O)F
Chemical ID:
7243946
Name [?]:
2-[2-(4-fluorophenyl)thiazol-4-yl]acetic acid
SMILES [?]:
c1cc(ccc1c2nc(cs2)CC(=O)O)F
InChi [?]:
InChI=1/C11H8FNO2S/c12-8-3-1-7(2-4-8)11-13-9(6-16-11)5-10(14)15/h1-4,6H,5H2,(H,14,15)
InChi Info:
AuxInfo=1/1/N:1,5,2,4,12,10,6,3,9,13,7,16,8,14,15,11/E:(1,2)(3,4)(14,15)/rA:16nCCCCCCCNCCSCCOOF/rB:s1;d2;s3;d4;d1s5;s6;d7;s8;d9;s7s10;s9;s12;d13;s13;s3;/rC:;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C11H8FNO2S
All Atoms:24
Heavy Atoms:16
Chiral Atoms:0
ZAP Information [?]
Total:6.46252
Area:400.192
Solvation:-3.54228
Coulombic:-34.7621
Bond Count [?]
All:17
Single:11
Double:6
Rotors:3
Chiral:0
Rigid Segments:3
Chemical Properties
Molecular Weight:237.251
H-Bond Donors:1
H-Bond Acceptors:2
XLogP:2.04
LogP (Chemaxon):2.71

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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