Chemical ID: 7010319

COc1ccc(cc1)c2cccc(c2)C(=O)Nc3ccccc3
Chemical ID:
7010319
Name [?]:
3-(4-methoxyphenyl)-N-phenyl-benzamide
SMILES [?]:
COc1ccc(cc1)c2cccc(c2)C(=O)Nc3ccccc3
InChi [?]:
InChI=1/C20H17NO2/c1-23-19-12-10-15(11-13-19)16-6-5-7-17(14-16)20(22)21-18-8-3-2-4-9-18/h2-14H,1H3,(H,21,22)
InChi Info:
AuxInfo=1/1/N:1,21,20,22,11,10,12,19,23,5,7,4,8,14,6,9,13,18,3,15,17,16,2/E:(3,4)(8,9)(10,11)(12,13)/rA:23nCOCCCCCCCCCCCCCONCCCCCC/rB:s1;s2;s3;d4;s5;d6;d3s7;s6;s9;d10;s11;d12;d9s13;s13;d15;s15;s17;s18;d19;s20;d21;d18s22;/rC:;;;;;;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C20H17NO2
All Atoms:40
Heavy Atoms:23
Chiral Atoms:0
ZAP Information [?]
Total:9.46933
Area:518.164
Solvation:-3.48476
Coulombic:-31.5116
Bond Count [?]
All:25
Single:15
Double:10
Rotors:5
Chiral:0
Rigid Segments:5
Chemical Properties
Molecular Weight:303.355
H-Bond Donors:1
H-Bond Acceptors:3
XLogP:4.85
LogP (Chemaxon):4.53

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