Chemical ID: 6524026

CN(Cc1ccccc1)C(=O)c2ccccc2NS(=O)(=O)c3ccc(cc3)F
Chemical ID:
6524026
Name [?]:
N-benzyl-2-(4-fluorophenyl)sulfonylamino-N-methyl-benzamide
SMILES [?]:
CN(Cc1ccccc1)C(=O)c2ccccc2NS(=O)(=O)c3ccc(cc3)F
InChi [?]:
InChI=1/C21H19FN2O3S/c1-24(15-16-7-3-2-4-8-16)21(25)19-9-5-6-10-20(19)23-28(26,27)18-13-11-17(22)12-14-18/h2-14,23H,15H2,1H3
InChi Info:
AuxInfo=1/0/N:1,7,6,8,14,15,5,9,13,16,24,26,23,27,3,4,25,22,12,17,10,28,18,2,11,20,21,19/E:(3,4)(7,8)(11,12)(13,14)(26,27)/CRV:28.6/rA:28nCNCCCCCCCCOCCCCCCNSOOCCCCCCF/rB:s1;s2;s3;s4;d5;s6;d7;d4s8;s2;d10;s10;s12;d13;s14;d15;d12s16;s17;s18;d19;d19;s19;s22;d23;s24;d25;d22s26;s25;/rC:;;;;;;;;;;;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C21H19FN2O3S
All Atoms:28
Heavy Atoms:28
Chiral Atoms:0
ZAP Information [?]
Total:10.4362
Area:569.884
Solvation:-3.81086
Coulombic:-35.3517
Bond Count [?]
All:30
Single:18
Double:12
Rotors:7
Chiral:0
Rigid Segments:6
Chemical Properties
Molecular Weight:398.452
H-Bond Donors:1
H-Bond Acceptors:5
XLogP:4.56
LogP (Chemaxon):3.67

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Descriptor Annotations

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