Chemical ID: 5513406

c1ccc(cc1)CNC(=O)c2cccc(c2)S(=O)(=O)Nc3ccc(cc3)F
Chemical ID:
5513406
Name [?]:
N-benzyl-3-[(4-fluorophenyl)sulfamoyl]benzamide
SMILES [?]:
c1ccc(cc1)CNC(=O)c2cccc(c2)S(=O)(=O)Nc3ccc(cc3)F
InChi [?]:
InChI=1/C20H17FN2O3S/c21-17-9-11-18(12-10-17)23-27(25,26)19-8-4-7-16(13-19)20(24)22-14-15-5-2-1-3-6-15/h1-13,23H,14H2,(H,22,24)
InChi Info:
AuxInfo=1/1/N:1,2,6,13,3,5,12,14,23,25,22,26,16,7,4,11,24,21,15,9,27,8,20,10,18,19,17/E:(2,3)(5,6)(9,10)(11,12)(25,26)/CRV:27.6/rA:27nCCCCCCCNCOCCCCCCSOONCCCCCCF/rB:s1;d2;s3;d4;d1s5;s4;s7;s8;d9;s9;s11;d12;s13;d14;d11s15;s15;d17;d17;s17;s20;s21;d22;s23;d24;d21s25;s24;/rC:;;;;;;;;;;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C20H17FN2O3S
All Atoms:27
Heavy Atoms:27
Chiral Atoms:0
ZAP Information [?]
Total:10.7261
Area:587.767
Solvation:-3.96807
Coulombic:-39.4196
Bond Count [?]
All:29
Single:17
Double:12
Rotors:7
Chiral:0
Rigid Segments:6
Chemical Properties
Molecular Weight:384.425
H-Bond Donors:2
H-Bond Acceptors:5
XLogP:3.99
LogP (Chemaxon):3.42

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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