Chemical ID: 6350117

CCS(=O)(=O)Nc1cccc2c1cccc2
Chemical ID:
6350117
Name [?]:
N-(1-naphthyl)ethanesulfonamide
SMILES [?]:
CCS(=O)(=O)Nc1cccc2c1cccc2
InChi [?]:
InChI=1/C12H13NO2S/c1-2-16(14,15)13-12-9-5-7-10-6-3-4-8-11(10)12/h3-9,13H,2H2,1H3
InChi Info:
AuxInfo=1/0/N:1,2,15,14,9,16,10,13,8,11,12,7,6,4,5,3/E:(14,15)/CRV:16.6/rA:16nCCSOONCCCCCCCCCC/rB:s1;s2;d3;d3;s3;s6;s7;d8;s9;d10;d7s11;s12;d13;s14;s11d15;/rC:;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C12H13NO2S
All Atoms:16
Heavy Atoms:16
Chiral Atoms:0
ZAP Information [?]
Total:7.58618
Area:393.144
Solvation:-2.24242
Coulombic:-11.9748
Bond Count [?]
All:17
Single:10
Double:7
Rotors:3
Chiral:0
Rigid Segments:3
Chemical Properties
Molecular Weight:235.303
H-Bond Donors:1
H-Bond Acceptors:3
XLogP:2.89
LogP (Chemaxon):2.02

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Descriptor Annotations

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