Chemical ID: 6218184

c1ccc(cc1)CC(=O)Nc2ncc(s2)Cc3cccc(c3)C(F)(F)F
Chemical ID:
6218184
Name [?]:
2-phenyl-N-[5-[[3-(trifluoromethyl)phenyl]methyl]thiazol-2-yl]-acetamide
SMILES [?]:
c1ccc(cc1)CC(=O)Nc2ncc(s2)Cc3cccc(c3)C(F)(F)F
InChi [?]:
InChI=1/C19H15F3N2OS/c20-19(21,22)15-8-4-7-14(9-15)10-16-12-23-18(26-16)24-17(25)11-13-5-2-1-3-6-13/h1-9,12H,10-11H2,(H,23,24,25)
InChi Info:
AuxInfo=1/1/N:1,2,6,19,3,5,18,20,22,16,7,13,4,17,21,14,8,11,23,24,25,26,12,10,9,15/E:(2,3)(5,6)(20,21,22)/rA:26nCCCCCCCCONCNCCSCCCCCCCCFFF/rB:s1;d2;s3;d4;d1s5;s4;s7;d8;s8;s10;d11;s12;d13;s11s14;s14;s16;s17;d18;s19;d20;d17s21;s21;s23;s23;s23;/rC:;;;;;;;;;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C19H15F3N2OS
All Atoms:26
Heavy Atoms:26
Chiral Atoms:0
ZAP Information [?]
Total:9.88741
Area:569.333
Solvation:-4.3459
Coulombic:-45.3385
Bond Count [?]
All:28
Single:19
Double:9
Rotors:7
Chiral:0
Rigid Segments:5
Chemical Properties
Molecular Weight:376.396
H-Bond Donors:1
H-Bond Acceptors:2
XLogP:3.68
LogP (Chemaxon):5.04

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