Chemical ID: 5513896

CC(C)CCCC(C)NS(=O)(=O)Cc1ccccc1Cl
Chemical ID:
5513896
Name [?]:
1-(2-chlorophenyl)-N-(1,5-dimethylhexyl)methanesulfonamide
SMILES [?]:
CC(C)CCCC(C)NS(=O)(=O)Cc1ccccc1Cl
InChi [?]:
InChI=1/C15H24ClNO2S/c1-12(2)7-6-8-13(3)17-20(18,19)11-14-9-4-5-10-15(14)16/h4-5,9-10,12-13,17H,6-8,11H2,1-3H3
InChi Info:
AuxInfo=1/0/N:1,3,8,16,17,5,4,6,15,18,13,2,7,14,19,20,9,11,12,10/E:(1,2)(18,19)/CRV:20.6/rA:20cCCCCCCCCNSOOCCCCCCCCl/rB:s1;s2;s2;s4;s5;s6;s7;s7;s9;d10;d10;s10;s13;s14;d15;s16;d17;d14s18;s19;/rC:;;;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C15H24ClNO2S
All Atoms:20
Heavy Atoms:20
Chiral Atoms:1
ZAP Information [?]
Total:10.5099
Area:519.599
Solvation:-2.48005
Coulombic:-13.3045
Bond Count [?]
All:20
Single:15
Double:5
Rotors:8
Chiral:0
Rigid Segments:5
Chemical Properties
Molecular Weight:317.875
H-Bond Donors:1
H-Bond Acceptors:3
XLogP:4.94
LogP (Chemaxon):4.03

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