Chemical ID: 7291383

Cc1ccc(cc1S(=O)(=O)Nc2ccc(cc2)OC)NC(=O)c3ccc(nc3)O
Chemical ID:
7291383
Name [?]:
6-hydroxy-N-[3-[(4-methoxyphenyl)sulfamoyl]-4-methyl-phenyl]-pyridine-3-carboxamide
SMILES [?]:
Cc1ccc(cc1S(=O)(=O)Nc2ccc(cc2)OC)NC(=O)c3ccc(nc3)O
InChi [?]:
InChI=1/C20H19N3O5S/c1-13-3-5-16(22-20(25)14-4-10-19(24)21-12-14)11-18(13)29(26,27)23-15-6-8-17(28-2)9-7-15/h3-12,23H,1-2H3,(H,21,24)(H,22,25)
InChi Info:
AuxInfo=1/1/N:1,19,3,24,4,13,17,14,16,25,6,28,2,23,12,5,15,7,26,21,27,20,11,29,22,9,10,18,8/E:(6,7)(8,9)(26,27)/CRV:29.6/rA:29nCCCCCCCSOONCCCCCCOCNCOCCCCNCO/rB:s1;s2;d3;s4;d5;d2s6;s7;d8;d8;s8;s11;s12;d13;s14;d15;d12s16;s15;s18;s5;s20;d21;s21;s23;d24;s25;d26;d23s27;s26;/rC:;;;;;;;;;;;;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C20H19N3O5S
All Atoms:48
Heavy Atoms:29
Chiral Atoms:0
ZAP Information [?]
Total:9.36161
Area:609.623
Solvation:-5.87897
Coulombic:-60.5975
Bond Count [?]
All:31
Single:19
Double:12
Rotors:7
Chiral:0
Rigid Segments:6
Chemical Properties
Molecular Weight:413.448
H-Bond Donors:3
H-Bond Acceptors:7
XLogP:2.9
LogP (Chemaxon):2.98

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Descriptor Annotations

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