Chemical ID: 4807040

c1ccc(c(c1)c2nc(no2)c3ccccc3F)C(=O)NCc4ccco4
Chemical ID:
4807040
Name [?]:
2-[3-(2-fluorophenyl)-1,2,4-oxadiazol-5-yl]-N-(2-furylmethyl)benzamide
SMILES [?]:
c1ccc(c(c1)c2nc(no2)c3ccccc3F)C(=O)NCc4ccco4
InChi [?]:
InChI=1/C20H14FN3O3/c21-17-10-4-3-9-16(17)18-23-20(27-24-18)15-8-2-1-7-14(15)19(25)22-12-13-6-5-11-26-13/h1-11H,12H2,(H,22,25)
InChi Info:
AuxInfo=1/1/N:2,1,14,15,25,24,3,6,13,16,26,22,23,4,5,12,17,9,19,7,18,21,8,10,20,27,11/rA:27nCCCCCCCNCNOCCCCCCFCONCCCCCO/rB:s1;d2;s3;d4;d1s5;s5;d7;s8;d9;s7s10;s9;s12;d13;s14;d15;d12s16;s17;s4;d19;s19;s21;s22;d23;s24;d25;s23s26;/rC:;;;;;;;;;;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C20H14FN3O3
All Atoms:27
Heavy Atoms:27
Chiral Atoms:0
ZAP Information [?]
Total:9.07842
Area:566.764
Solvation:-5.09069
Coulombic:-44.9767
Bond Count [?]
All:30
Single:19
Double:11
Rotors:6
Chiral:0
Rigid Segments:6
Chemical Properties
Molecular Weight:363.342
H-Bond Donors:1
H-Bond Acceptors:2
XLogP:4.08
LogP (Chemaxon):3.84

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Descriptor Annotations

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