Chemical ID: 4246439

CCOc1ccc(cc1)S(=O)(=O)Nc2cccc(c2)F
Chemical ID:
4246439
Name [?]:
4-ethoxy-N-(3-fluorophenyl)-benzenesulfonamide
SMILES [?]:
CCOc1ccc(cc1)S(=O)(=O)Nc2cccc(c2)F
InChi [?]:
InChI=1/C14H14FNO3S/c1-2-19-13-6-8-14(9-7-13)20(17,18)16-12-5-3-4-11(15)10-12/h3-10,16H,2H2,1H3
InChi Info:
AuxInfo=1/0/N:1,2,16,17,15,5,9,6,8,19,18,14,4,7,20,13,11,12,3,10/E:(6,7)(8,9)(17,18)/CRV:20.6/rA:20nCCOCCCCCCSOONCCCCCCF/rB:s1;s2;s3;s4;d5;s6;d7;d4s8;s7;d10;d10;s10;s13;s14;d15;s16;d17;d14s18;s18;/rC:;;;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C14H14FNO3S
All Atoms:20
Heavy Atoms:20
Chiral Atoms:0
ZAP Information [?]
Total:7.5984
Area:458.704
Solvation:-3.8692
Coulombic:-23.3423
Bond Count [?]
All:21
Single:13
Double:8
Rotors:5
Chiral:0
Rigid Segments:4
Chemical Properties
Molecular Weight:295.33
H-Bond Donors:1
H-Bond Acceptors:4
XLogP:3.21
LogP (Chemaxon):2.84

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