Chemical ID: 7523532

CC(C)C(=O)Nc1ncc(s1)Cc2cc(ccc2Cl)C(F)(F)F
Chemical ID:
7523532
Name [?]:
N-[5-[[2-chloro-5-(trifluoromethyl)phenyl]methyl]thiazol-2-yl]-2-methyl-propanamide
SMILES [?]:
CC(C)C(=O)Nc1ncc(s1)Cc2cc(ccc2Cl)C(F)(F)F
InChi [?]:
InChI=1/C15H14ClF3N2OS/c1-8(2)13(22)21-14-20-7-11(23-14)6-9-5-10(15(17,18)19)3-4-12(9)16/h3-5,7-8H,6H2,1-2H3,(H,20,21,22)
InChi Info:
AuxInfo=1/1/N:1,3,16,17,14,12,9,2,13,15,10,18,4,7,20,19,21,22,23,8,6,5,11/E:(1,2)(17,18,19)/rA:23nCCCCONCNCCSCCCCCCCClCFFF/rB:s1;s2;s2;d4;s4;s6;d7;s8;d9;s7s10;s10;s12;s13;d14;s15;d16;d13s17;s18;s15;s20;s20;s20;/rC:;;;;;;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C15H14ClF3N2OS
All Atoms:37
Heavy Atoms:23
Chiral Atoms:None
ZAP Information [?]
Total:9.55959
Area:528.205
Solvation:-3.64554
Coulombic:-44.5968
Bond Count [?]
All:24
Single:18
Double:6
Rotors:6
Chiral:None
Rigid Segments:None
Chemical Properties
Molecular Weight:None
H-Bond Donors:None
H-Bond Acceptors:None
XLogP:3.32
LogP (Chemaxon):None

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Descriptor Annotations

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