Chemical ID: 5282445

CC(=O)Nc1ccc(cc1)NC(=O)c2ccc(o2)c3cccc(c3)C(F)(F)F
Chemical ID:
5282445
Name [?]:
N-(4-acetamidophenyl)-5-[3-(trifluoromethyl)phenyl]-furan-2-carboxamide
SMILES [?]:
CC(=O)Nc1ccc(cc1)NC(=O)c2ccc(o2)c3cccc(c3)C(F)(F)F
InChi [?]:
InChI=1/C20H15F3N2O3/c1-12(26)24-15-5-7-16(8-6-15)25-19(27)18-10-9-17(28-18)13-3-2-4-14(11-13)20(21,22)23/h2-11H,1H3,(H,24,26)(H,25,27)
InChi Info:
AuxInfo=1/1/N:1,21,20,22,6,10,7,9,16,15,24,2,19,23,5,8,17,14,12,25,26,27,28,4,11,3,13,18/E:(5,6)(7,8)(21,22,23)/rA:28nCCONCCCCCCNCOCCCCOCCCCCCCFFF/rB:s1;d2;s2;s4;s5;d6;s7;d8;d5s9;s8;s11;d12;s12;d14;s15;d16;s14s17;s17;s19;d20;s21;d22;d19s23;s23;s25;s25;s25;/rC:;;;;;;;;;;;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C20H15F3N2O3
All Atoms:28
Heavy Atoms:28
Chiral Atoms:0
ZAP Information [?]
Total:10.333
Area:587.484
Solvation:-4.35406
Coulombic:-68.8034
Bond Count [?]
All:30
Single:20
Double:10
Rotors:7
Chiral:0
Rigid Segments:6
Chemical Properties
Molecular Weight:388.34
H-Bond Donors:2
H-Bond Acceptors:4
XLogP:3.4
LogP (Chemaxon):3.71

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Descriptor Annotations

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