Chemical ID: 4184999

c1ccc(cc1)NC(=O)Nc2ccc(cc2)OC(F)(F)F
Chemical ID:
4184999
Name [?]:
1-phenyl-3-[4-(trifluoromethoxy)phenyl]-urea
SMILES [?]:
c1ccc(cc1)NC(=O)Nc2ccc(cc2)OC(F)(F)F
InChi [?]:
InChI=1/C14H11F3N2O2/c15-14(16,17)21-12-8-6-11(7-9-12)19-13(20)18-10-4-2-1-3-5-10/h1-9H,(H2,18,19,20)
InChi Info:
AuxInfo=1/1/N:1,2,6,3,5,12,16,13,15,4,11,14,8,18,19,20,21,7,10,9,17/E:(2,3)(4,5)(6,7)(8,9)(15,16,17)/rA:21nCCCCCCNCONCCCCCCOCFFF/rB:s1;d2;s3;d4;d1s5;s4;s7;d8;s8;s10;s11;d12;s13;d14;d11s15;s14;s17;s18;s18;s18;/rC:;;;;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C14H11F3N2O2
All Atoms:21
Heavy Atoms:21
Chiral Atoms:0
ZAP Information [?]
Total:9.05241
Area:450.272
Solvation:-2.2044
Coulombic:-67.4285
Bond Count [?]
All:22
Single:15
Double:7
Rotors:6
Chiral:0
Rigid Segments:4
Chemical Properties
Molecular Weight:296.245
H-Bond Donors:2
H-Bond Acceptors:4
XLogP:3.65
LogP (Chemaxon):4.16

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