Chemical ID: 7020357

CCNc1ccc(cc1NC(=O)c2ccccc2C)S(=O)(=O)C(F)(F)F
Chemical ID:
7020357
Name [?]:
N-[2-ethylamino-5-(trifluoromethylsulfonyl)phenyl]-2-methyl-benzamide
SMILES [?]:
CCNc1ccc(cc1NC(=O)c2ccccc2C)S(=O)(=O)C(F)(F)F
InChi [?]:
InChI=1/C17H17F3N2O3S/c1-3-21-14-9-8-12(26(24,25)17(18,19)20)10-15(14)22-16(23)13-7-5-4-6-11(13)2/h4-10,21H,3H2,1-2H3,(H,22,23)
InChi Info:
AuxInfo=1/1/N:1,19,2,16,15,17,14,6,5,8,18,7,13,4,9,11,23,24,25,26,3,10,12,21,22,20/E:(18,19,20)(24,25)/CRV:26.6/rA:26nCCNCCCCCCNCOCCCCCCCSOOCFFF/rB:s1;s2;s3;s4;d5;s6;d7;d4s8;s9;s10;d11;s11;s13;d14;s15;d16;d13s17;s18;s7;d20;d20;s20;s23;s23;s23;/rC:;;;;;;;;;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C17H17F3N2O3S
All Atoms:43
Heavy Atoms:26
Chiral Atoms:0
ZAP Information [?]
Total:11.0104
Area:550.868
Solvation:-2.76127
Coulombic:-61.698
Bond Count [?]
All:27
Single:18
Double:9
Rotors:7
Chiral:0
Rigid Segments:6
Chemical Properties
Molecular Weight:386.39
H-Bond Donors:2
H-Bond Acceptors:5
XLogP:4.02
LogP (Chemaxon):4.38

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