Chemical ID: 4277572

Cc1ccc(cc1N)S(=O)(=O)Nc2ccccc2
Chemical ID:
4277572
Name [?]:
3-amino-4-methyl-N-phenyl-benzenesulfonamide
SMILES [?]:
Cc1ccc(cc1N)S(=O)(=O)Nc2ccccc2
InChi [?]:
InChI=1/C13H14N2O2S/c1-10-7-8-12(9-13(10)14)18(16,17)15-11-5-3-2-4-6-11/h2-9,15H,14H2,1H3
InChi Info:
AuxInfo=1/0/N:1,16,15,17,14,18,3,4,6,2,13,5,7,8,12,10,11,9/E:(3,4)(5,6)(16,17)/CRV:18.6/rA:18nCCCCCCCNSOONCCCCCC/rB:s1;s2;d3;s4;d5;d2s6;s7;s5;d9;d9;s9;s12;s13;d14;s15;d16;d13s17;/rC:;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C13H14N2O2S
All Atoms:18
Heavy Atoms:18
Chiral Atoms:0
ZAP Information [?]
Total:8.71088
Area:425.531
Solvation:-1.92738
Coulombic:-29.7021
Bond Count [?]
All:19
Single:11
Double:8
Rotors:3
Chiral:0
Rigid Segments:3
Chemical Properties
Molecular Weight:262.329
H-Bond Donors:3
H-Bond Acceptors:4
XLogP:2.12
LogP (Chemaxon):2.29

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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