Chemical ID: 5822976

Cc1ccc(cc1)S(=O)(=O)N(C(C)C)C(C)C
Chemical ID:
5822976
Name [?]:
N,N-diisopropyl-4-methyl-benzenesulfonamide
SMILES [?]:
Cc1ccc(cc1)S(=O)(=O)N(C(C)C)C(C)C
InChi [?]:
InChI=1/C13H21NO2S/c1-10(2)14(11(3)4)17(15,16)13-8-6-12(5)7-9-13/h6-11H,1-5H3
InChi Info:
AuxInfo=1/0/N:13,14,16,17,1,3,7,4,6,12,15,2,5,11,9,10,8/E:(1,2,3,4)(6,7)(8,9)(10,11)(15,16)/CRV:17.6/rA:17nCCCCCCCSOONCCCCCC/rB:s1;s2;d3;s4;d5;d2s6;s5;d8;d8;s8;s11;s12;s12;s11;s15;s15;/rC:;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C13H21NO2S
All Atoms:17
Heavy Atoms:17
Chiral Atoms:0
ZAP Information [?]
Total:8.93109
Area:418.569
Solvation:-1.53314
Coulombic:-9.12074
Bond Count [?]
All:17
Single:12
Double:5
Rotors:4
Chiral:0
Rigid Segments:4
Chemical Properties
Molecular Weight:255.377
H-Bond Donors:0
H-Bond Acceptors:3
XLogP:3.31
LogP (Chemaxon):3.15

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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