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Chemical ID: 6205690
Chemical ID:
6205690
Name [?]:
N-cyclohexyl-4-isobutyl-benzenesulfonamide
SMILES [?]:
CC(C)Cc1ccc(cc1)S(=O)(=O)NC2CCCCC2
InChi [?]:
InChI=1/C16H25NO2S/c1-13(2)12-14-8-10-16(11-9-14)20(18,19)17-15-6-4-3-5-7-15/h8-11,13,15,17H,3-7,12H2,1-2H3
InChi Info:
AuxInfo=1/0/N:1,3,18,17,19,16,20,6,10,7,9,4,2,5,15,8,14,12,13,11/E:(1,2)(4,5)(6,7)(8,9)(10,11)(18,19)/CRV:20.6/rA:20nCCCCCCCCCCSOONCCCCCC/rB:s1;s2;s2;s4;s5;d6;s7;d8;d5s9;s8;d11;d11;s11;s14;s15;s16;s17;s18;s15s19;/rC:;;;;;;;;;;;;;;;;;;;;
Chemical Details
Atom Count
Formula: | C16H25NO2S |
All Atoms: | 20 |
Heavy Atoms: | 20 |
Chiral Atoms: | 0 |
ZAP Information [?]
Total: | 10.7851 |
Area: | 494.633 |
Solvation: | -1.58071 |
Coulombic: | -14.9849 |
Bond Count [?]
All: | 21 |
Single: | 16 |
Double: | 5 |
Rotors: | 5 |
Chiral: | 0 |
Rigid Segments: | 4 |
Chemical Properties
Molecular Weight: | 295.441 |
H-Bond Donors: | 1 |
H-Bond Acceptors: | 3 |
XLogP: | 4.68 |
LogP (Chemaxon): | 4.1 |
Name Annotations
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Experimental Annotations
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Descriptor Annotations
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