Chemical ID: 4316455

Cc1cc(c(c(c1NC(=O)C(F)(F)F)C)NC(=O)C(F)(F)F)C
Chemical ID:
4316455
Name [?]:
2,2,2-trifluoro-N-[2,4,6-trimethyl-3-(2,2,2-trifluoroacetyl)amino-phenyl]-acetamide
SMILES [?]:
Cc1cc(c(c(c1NC(=O)C(F)(F)F)C)NC(=O)C(F)(F)F)C
InChi [?]:
InChI=1/C13H12F6N2O2/c1-5-4-6(2)9(21-11(23)13(17,18)19)7(3)8(5)20-10(22)12(14,15)16/h4H,1-3H3,(H,20,22)(H,21,23)
InChi Info:
AuxInfo=1/1/N:1,23,15,3,2,4,6,7,5,9,17,11,19,12,13,14,20,21,22,8,16,10,18/E:(1,2)(5,6)(8,9)(10,11)(12,13)(14,15,16,17,18,19)(20,21)(22,23)/gE:(1,2)/rA:23nCCCCCCCNCOCFFFCNCOCFFFC/rB:s1;s2;d3;s4;d5;d2s6;s7;s8;d9;s9;s11;s11;s11;s6;s5;s16;d17;s17;s19;s19;s19;s4;/rC:;;;;;;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C13H12F6N2O2
All Atoms:23
Heavy Atoms:23
Chiral Atoms:0
ZAP Information [?]
Total:8.04348
Area:460.229
Solvation:-3.46225
Coulombic:-83.9663
Bond Count [?]
All:23
Single:18
Double:5
Rotors:6
Chiral:0
Rigid Segments:5
Chemical Properties
Molecular Weight:342.237
H-Bond Donors:2
H-Bond Acceptors:4
XLogP:2.61
LogP (Chemaxon):1.72

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Descriptor Annotations

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