Chemical ID: 4543743

Cc1ccc(cc1NC(=O)c2ccc(cc2)F)C(=O)OC
Chemical ID:
4543743
Name [?]:
methyl 3-(4-fluorobenzoyl)amino-4-methyl-benzoate
SMILES [?]:
Cc1ccc(cc1NC(=O)c2ccc(cc2)F)C(=O)OC
InChi [?]:
InChI=1/C16H14FNO3/c1-10-3-4-12(16(20)21-2)9-14(10)18-15(19)11-5-7-13(17)8-6-11/h3-9H,1-2H3,(H,18,19)
InChi Info:
AuxInfo=1/1/N:1,21,3,4,12,16,13,15,6,2,11,5,14,7,9,18,17,8,10,19,20/E:(5,6)(7,8)/rA:21nCCCCCCCNCOCCCCCCFCOOC/rB:s1;s2;d3;s4;d5;d2s6;s7;s8;d9;s9;s11;d12;s13;d14;d11s15;s14;s5;d18;s18;s20;/rC:;;;;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C16H14FNO3
All Atoms:21
Heavy Atoms:21
Chiral Atoms:0
ZAP Information [?]
Total:8.33236
Area:479.716
Solvation:-3.66054
Coulombic:-45.2188
Bond Count [?]
All:22
Single:14
Double:8
Rotors:5
Chiral:0
Rigid Segments:5
Chemical Properties
Molecular Weight:287.286
H-Bond Donors:1
H-Bond Acceptors:4
XLogP:3.32
LogP (Chemaxon):2.61

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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