Chemical ID: 4350029

Cc1ccc(c(c1)S(=O)(=O)Nc2ccccc2)C
Chemical ID:
4350029
Name [?]:
2,5-dimethyl-N-phenyl-benzenesulfonamide
SMILES [?]:
Cc1ccc(c(c1)S(=O)(=O)Nc2ccccc2)C
InChi [?]:
InChI=1/C14H15NO2S/c1-11-8-9-12(2)14(10-11)18(16,17)15-13-6-4-3-5-7-13/h3-10,15H,1-2H3
InChi Info:
AuxInfo=1/0/N:1,18,15,14,16,13,17,3,4,7,2,5,12,6,11,9,10,8/E:(4,5)(6,7)(16,17)/CRV:18.6/rA:18nCCCCCCCSOONCCCCCCC/rB:s1;s2;d3;s4;d5;d2s6;s6;d8;d8;s8;s11;s12;d13;s14;d15;d12s16;s5;/rC:;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C14H15NO2S
All Atoms:18
Heavy Atoms:18
Chiral Atoms:0
ZAP Information [?]
Total:8.88497
Area:421.96
Solvation:-1.66404
Coulombic:-14.3887
Bond Count [?]
All:19
Single:11
Double:8
Rotors:3
Chiral:0
Rigid Segments:3
Chemical Properties
Molecular Weight:261.34
H-Bond Donors:1
H-Bond Acceptors:3
XLogP:3.38
LogP (Chemaxon):3.54

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Descriptor Annotations

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