Chemical ID: 4190129

Cc1ccc2c(c1)nc(o2)c3cc(ccc3O)NC(=O)c4ccc(cc4)F
Chemical ID:
4190129
Name [?]:
4-fluoro-N-[4-hydroxy-3-(5-methylbenzooxazol-2-yl)-phenyl]-benzamide
SMILES [?]:
Cc1ccc2c(c1)nc(o2)c3cc(ccc3O)NC(=O)c4ccc(cc4)F
InChi [?]:
InChI=1/C21H15FN2O3/c1-12-2-9-19-17(10-12)24-21(27-19)16-11-15(7-8-18(16)25)23-20(26)13-3-5-14(22)6-4-13/h2-11,25H,1H3,(H,23,26)
InChi Info:
AuxInfo=1/1/N:1,3,22,26,23,25,14,15,4,7,12,2,21,24,13,11,6,16,5,19,9,27,18,8,17,20,10/E:(3,4)(5,6)/rA:27nCCCCCCCNCOCCCCCCONCOCCCCCCF/rB:s1;s2;d3;s4;d5;d2s6;s6;d8;s5s9;s9;s11;d12;s13;d14;d11s15;s16;s13;s18;d19;s19;s21;d22;s23;d24;d21s25;s24;/rC:;;;;;;;;;;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C21H15FN2O3
All Atoms:27
Heavy Atoms:27
Chiral Atoms:0
ZAP Information [?]
Total:9.50496
Area:560.78
Solvation:-4.51453
Coulombic:-55.9991
Bond Count [?]
All:30
Single:19
Double:11
Rotors:4
Chiral:0
Rigid Segments:4
Chemical Properties
Molecular Weight:362.354
H-Bond Donors:2
H-Bond Acceptors:3
XLogP:3.9
LogP (Chemaxon):5.4

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