Chemical ID: 6510467

Cc1ccc(cc1)S(=O)(=O)Nc2ccccc2CC=C
Chemical ID:
6510467
Name [?]:
N-(2-allylphenyl)-4-methyl-benzenesulfonamide
SMILES [?]:
Cc1ccc(cc1)S(=O)(=O)Nc2ccccc2CC=C
InChi [?]:
InChI=1/C16H17NO2S/c1-3-6-14-7-4-5-8-16(14)17-20(18,19)15-11-9-13(2)10-12-15/h3-5,7-12,17H,1,6H2,2H3
InChi Info:
AuxInfo=1/0/N:20,1,19,15,14,18,16,13,3,7,4,6,2,17,5,12,11,9,10,8/E:(9,10)(11,12)(18,19)/CRV:20.6/rA:20nCCCCCCCSOONCCCCCCCCC/rB:s1;s2;d3;s4;d5;d2s6;s5;d8;d8;s8;s11;s12;d13;s14;d15;d12s16;s17;s18;d19;/rC:;;;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C16H17NO2S
All Atoms:20
Heavy Atoms:20
Chiral Atoms:0
ZAP Information [?]
Total:9.71765
Area:458.825
Solvation:-1.75298
Coulombic:-16.1051
Bond Count [?]
All:21
Single:12
Double:9
Rotors:5
Chiral:0
Rigid Segments:4
Chemical Properties
Molecular Weight:287.378
H-Bond Donors:1
H-Bond Acceptors:3
XLogP:4.23
LogP (Chemaxon):4.12

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