Chemical ID: 7468863

Cc1cccc(c1NS(=O)(=O)c2ccc(cc2)NC(=O)c3cccnc3)C
Chemical ID:
7468863
Name [?]:
N-[4-[(2,6-dimethylphenyl)sulfamoyl]phenyl]pyridine-3-carboxamide
SMILES [?]:
Cc1cccc(c1NS(=O)(=O)c2ccc(cc2)NC(=O)c3cccnc3)C
InChi [?]:
InChI=1/C20H19N3O3S/c1-14-5-3-6-15(2)19(14)23-27(25,26)18-10-8-17(9-11-18)22-20(24)16-7-4-12-21-13-16/h3-13,23H,1-2H3,(H,22,24)
InChi Info:
AuxInfo=1/1/N:1,27,4,23,3,5,22,14,16,13,17,24,26,2,6,21,15,12,7,19,25,18,8,20,10,11,9/E:(1,2)(5,6)(8,9)(10,11)(14,15)(25,26)/CRV:27.6/rA:27nCCCCCCCNSOOCCCCCCNCOCCCCNCC/rB:s1;s2;d3;s4;d5;d2s6;s7;s8;d9;d9;s9;s12;d13;s14;d15;d12s16;s15;s18;d19;s19;s21;d22;s23;d24;d21s25;s6;/rC:;;;;;;;;;;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C20H19N3O3S
All Atoms:46
Heavy Atoms:27
Chiral Atoms:0
ZAP Information [?]
Total:10.6853
Area:561.616
Solvation:-3.35511
Coulombic:-38.3767
Bond Count [?]
All:29
Single:17
Double:12
Rotors:6
Chiral:0
Rigid Segments:5
Chemical Properties
Molecular Weight:381.449
H-Bond Donors:2
H-Bond Acceptors:5
XLogP:2.89
LogP (Chemaxon):3.29

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Descriptor Annotations

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