Chemical ID: 7701404

c1ccc(c(c1)C(=O)NN=Cc2cccc(c2)F)OCc3ccc(cc3)Cl
Chemical ID:
7701404
Name [?]:
None
SMILES [?]:
c1ccc(c(c1)C(=O)NN=Cc2cccc(c2)F)OCc3ccc(cc3)Cl
InChi [?]:
InChI=1/C21H16ClFN2O2/c22-17-10-8-15(9-11-17)14-27-20-7-2-1-6-19(20)21(26)25-24-13-16-4-3-5-18(23)12-16/h1-13H,14H2,(H,25,26)
InChi Info:
AuxInfo=1/1/N:1,2,14,13,15,6,3,22,26,23,25,17,11,20,21,12,24,16,5,4,7,27,18,10,9,8,19/E:(8,9)(10,11)/rA:27nCCCCCCCONNCCCCCCCFOCCCCCCCCl/rB:s1;d2;s3;d4;d1s5;s5;d7;s7;s9;w10;s11;s12;d13;s14;d15;d12s16;s16;s4;s19;s20;s21;d22;s23;d24;d21s25;s24;/rC:;;;;;;;;;;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C21H16ClFN2O2
All Atoms:43
Heavy Atoms:27
Chiral Atoms:None
ZAP Information [?]
Total:9.13415
Area:618.645
Solvation:-6.33197
Coulombic:-32.0161
Bond Count [?]
All:29
Single:18
Double:11
Rotors:7
Chiral:None
Rigid Segments:None
Chemical Properties
Molecular Weight:None
H-Bond Donors:None
H-Bond Acceptors:None
XLogP:6.4
LogP (Chemaxon):None

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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