Chemical ID: 7399047

Cc1ccc(cc1)c2nc(on2)CCC(=O)Nc3ccc(cc3)C(=O)N
Chemical ID:
7399047
Name [?]:
4-[3-[3-(p-tolyl)-1,2,4-oxadiazol-5-yl]propanoylamino]benzamide
SMILES [?]:
Cc1ccc(cc1)c2nc(on2)CCC(=O)Nc3ccc(cc3)C(=O)N
InChi [?]:
InChI=1/C19H18N4O3/c1-12-2-4-14(5-3-12)19-22-17(26-23-19)11-10-16(24)21-15-8-6-13(7-9-15)18(20)25/h2-9H,10-11H2,1H3,(H2,20,25)(H,21,24)
InChi Info:
AuxInfo=1/1/N:1,3,7,4,6,20,22,19,23,14,13,2,21,5,18,15,10,24,8,26,17,9,12,16,25,11/E:(2,3)(4,5)(6,7)(8,9)/rA:26nCCCCCCCCNCONCCCONCCCCCCCON/rB:s1;s2;d3;s4;d5;d2s6;s5;s8;d9;s10;d8s11;s10;s13;s14;d15;s15;s17;s18;d19;s20;d21;d18s22;s21;d24;s24;/rC:;;;;;;;;;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C19H18N4O3
All Atoms:44
Heavy Atoms:26
Chiral Atoms:0
ZAP Information [?]
Total:10.9802
Area:589.9
Solvation:-3.76733
Coulombic:-57.4377
Bond Count [?]
All:28
Single:18
Double:10
Rotors:7
Chiral:0
Rigid Segments:6
Chemical Properties
Molecular Weight:350.371
H-Bond Donors:3
H-Bond Acceptors:4
XLogP:2.44
LogP (Chemaxon):2.52

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Descriptor Annotations

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