Chemical ID: 4743852

CCCCN(C(C)C)S(=O)(=O)c1ccc(cc1)C
Chemical ID:
4743852
Name [?]:
N-butyl-N-isopropyl-4-methyl-benzenesulfonamide
SMILES [?]:
CCCCN(C(C)C)S(=O)(=O)c1ccc(cc1)C
InChi [?]:
InChI=1/C14H23NO2S/c1-5-6-11-15(12(2)3)18(16,17)14-9-7-13(4)8-10-14/h7-10,12H,5-6,11H2,1-4H3
InChi Info:
AuxInfo=1/0/N:1,7,8,18,2,3,14,16,13,17,4,6,15,12,5,10,11,9/E:(2,3)(7,8)(9,10)(16,17)/CRV:18.6/rA:18cCCCCNCCCSOOCCCCCCC/rB:s1;s2;s3;s4;s5;s6;s6;s5;d9;d9;s9;s12;d13;s14;d15;d12s16;s15;/rC:;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C14H23NO2S
All Atoms:18
Heavy Atoms:18
Chiral Atoms:1
ZAP Information [?]
Total:10.0282
Area:465.142
Solvation:-1.60032
Coulombic:-9.62743
Bond Count [?]
All:18
Single:13
Double:5
Rotors:6
Chiral:0
Rigid Segments:5
Chemical Properties
Molecular Weight:269.404
H-Bond Donors:0
H-Bond Acceptors:3
XLogP:3.78
LogP (Chemaxon):3.6

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