Chemical ID: 5011616

Cc1ccc(cc1)NC(=O)c2ccc3c(c2)nc(c(n3)c4ccccc4)c5ccccc5
Chemical ID:
5011616
Name [?]:
2,3-diphenyl-N-(p-tolyl)quinoxaline-6-carboxamide
SMILES [?]:
Cc1ccc(cc1)NC(=O)c2ccc3c(c2)nc(c(n3)c4ccccc4)c5ccccc5
InChi [?]:
InChI=1/C28H21N3O/c1-19-12-15-23(16-13-19)29-28(32)22-14-17-24-25(18-22)31-27(21-10-6-3-7-11-21)26(30-24)20-8-4-2-5-9-20/h2-18H,1H3,(H,29,32)
InChi Info:
AuxInfo=1/1/N:1,24,30,23,25,29,31,22,26,28,32,3,7,12,4,6,13,16,2,21,27,11,5,14,15,19,18,9,8,20,17,10/E:(4,5)(6,7)(8,9)(10,11)(12,13)(15,16)/rA:32nCCCCCCCNCOCCCCCCNCCNCCCCCCCCCCCC/rB:s1;s2;d3;s4;d5;d2s6;s5;s8;d9;s9;s11;d12;s13;s14;d11s15;d15;s17;d18;d14s19;s19;s21;d22;s23;d24;d21s25;s18;s27;d28;s29;d30;d27s31;/rC:;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C28H21N3O
All Atoms:32
Heavy Atoms:32
Chiral Atoms:0
ZAP Information [?]
Total:13.2462
Area:640.449
Solvation:-2.76503
Coulombic:-37.1611
Bond Count [?]
All:36
Single:21
Double:15
Rotors:5
Chiral:0
Rigid Segments:5
Chemical Properties
Molecular Weight:415.486
H-Bond Donors:1
H-Bond Acceptors:2
XLogP:6.91
LogP (Chemaxon):6.91

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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