Chemical ID: 4724665

CC(=O)c1ccc(cc1)Oc2nc(on2)c3ccccc3F
Chemical ID:
4724665
Name [?]:
1-[4-[[5-(2-fluorophenyl)-1,2,4-oxadiazol-3-yl]oxy]phenyl]ethanone
SMILES [?]:
CC(=O)c1ccc(cc1)Oc2nc(on2)c3ccccc3F
InChi [?]:
InChI=1/C16H11FN2O3/c1-10(20)11-6-8-12(9-7-11)21-16-18-15(22-19-16)13-4-2-3-5-14(13)17/h2-9H,1H3
InChi Info:
AuxInfo=1/0/N:1,18,19,17,20,5,9,6,8,2,4,7,16,21,13,11,22,12,15,3,10,14/E:(6,7)(8,9)/rA:22nCCOCCCCCCOCNCONCCCCCCF/rB:s1;d2;s2;s4;d5;s6;d7;d4s8;s7;s10;s11;d12;s13;d11s14;s13;s16;d17;s18;d19;d16s20;s21;/rC:;;;;;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C16H11FN2O3
All Atoms:22
Heavy Atoms:22
Chiral Atoms:0
ZAP Information [?]
Total:8.33462
Area:483.429
Solvation:-3.7511
Coulombic:-35.1511
Bond Count [?]
All:24
Single:15
Double:9
Rotors:4
Chiral:0
Rigid Segments:4
Chemical Properties
Molecular Weight:298.269
H-Bond Donors:0
H-Bond Acceptors:2
XLogP:3.8
LogP (Chemaxon):3.59

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Descriptor Annotations

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