Chemical ID: 7301825

Cc1ccc(c(c1)C)NS(=O)(=O)c2cc(ccc2C)C
Chemical ID:
7301825
Name [?]:
N-(2,4-dimethylphenyl)-2,5-dimethyl-benzenesulfonamide
SMILES [?]:
Cc1ccc(c(c1)C)NS(=O)(=O)c2cc(ccc2C)C
InChi [?]:
InChI=1/C16H19NO2S/c1-11-6-8-15(14(4)9-11)17-20(18,19)16-10-12(2)5-7-13(16)3/h5-10,17H,1-4H3
InChi Info:
AuxInfo=1/0/N:1,20,19,8,16,3,17,4,7,14,2,15,18,6,5,13,9,11,12,10/E:(18,19)/CRV:20.6/rA:20nCCCCCCCCNSOOCCCCCCCC/rB:s1;s2;d3;s4;d5;d2s6;s6;s5;s9;d10;d10;s10;s13;d14;s15;d16;d13s17;s18;s15;/rC:;;;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C16H19NO2S
All Atoms:39
Heavy Atoms:20
Chiral Atoms:0
ZAP Information [?]
Total:9.76564
Area:463.126
Solvation:-1.8125
Coulombic:-13.7496
Bond Count [?]
All:21
Single:13
Double:8
Rotors:3
Chiral:0
Rigid Segments:3
Chemical Properties
Molecular Weight:289.394
H-Bond Donors:1
H-Bond Acceptors:3
XLogP:4.04
LogP (Chemaxon):4.48

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