Chemical ID: 5020018

Cc1ccc(cc1)C(=O)N(C)c2ccc(cc2)C(C(F)(F)F)(C(F)(F)F)O
Chemical ID:
5020018
Name [?]:
N,4-dimethyl-N-[4-[2,2,2-trifluoro-1-hydroxy-1-(trifluoromethyl)ethyl]phenyl]-benzamide
SMILES [?]:
Cc1ccc(cc1)C(=O)N(C)c2ccc(cc2)C(C(F)(F)F)(C(F)(F)F)O
InChi [?]:
InChI=1/C18H15F6NO2/c1-11-3-5-12(6-4-11)15(26)25(2)14-9-7-13(8-10-14)16(27,17(19,20)21)18(22,23)24/h3-10,27H,1-2H3
InChi Info:
AuxInfo=1/0/N:1,11,3,7,4,6,14,16,13,17,2,5,15,12,8,18,19,23,20,21,22,24,25,26,10,9,27/E:(3,4)(5,6)(7,8)(9,10)(17,18)(19,20,21,22,23,24)/rA:27nCCCCCCCCONCCCCCCCCCFFFCFFFO/rB:s1;s2;d3;s4;d5;d2s6;s5;d8;s8;s10;s10;s12;d13;s14;d15;d12s16;s15;s18;s19;s19;s19;s18;s23;s23;s23;s18;/rC:;;;;;;;;;;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C18H15F6NO2
All Atoms:27
Heavy Atoms:27
Chiral Atoms:0
ZAP Information [?]
Total:9.61858
Area:521.416
Solvation:-3.41682
Coulombic:-72.4295
Bond Count [?]
All:28
Single:21
Double:7
Rotors:6
Chiral:0
Rigid Segments:7
Chemical Properties
Molecular Weight:391.308
H-Bond Donors:1
H-Bond Acceptors:3
XLogP:5.4
LogP (Chemaxon):4.56

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