Chemical ID: 5402738

CCOc1cccc(c1)C(NC(=O)c2ccccc2)NC(=O)c3ccccc3
Chemical ID:
5402738
Name [?]:
N-[benzamido-(3-ethoxyphenyl)-methyl]benzamide
SMILES [?]:
CCOc1cccc(c1)C(NC(=O)c2ccccc2)NC(=O)c3ccccc3
InChi [?]:
InChI=1/C23H22N2O3/c1-2-28-20-15-9-14-19(16-20)21(24-22(26)17-10-5-3-6-11-17)25-23(27)18-12-7-4-8-13-18/h3-16,21H,2H2,1H3,(H,24,26)(H,25,27)
InChi Info:
AuxInfo=1/1/N:1,2,17,26,16,18,25,27,6,15,19,24,28,7,5,9,14,23,8,4,10,12,21,11,20,13,22,3/E:(3,4)(5,6,7,8)(10,11,12,13)(17,18)(22,23)(24,25)(26,27)/gE:(1,2)/rA:28nCCOCCCCCCCNCOCCCCCCNCOCCCCCC/rB:s1;s2;s3;s4;d5;s6;d7;d4s8;s8;s10;s11;d12;s12;s14;d15;s16;d17;d14s18;s10;s20;d21;s21;s23;d24;s25;d26;d23s27;/rC:;;;;;;;;;;;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C23H22N2O3
All Atoms:28
Heavy Atoms:28
Chiral Atoms:0
ZAP Information [?]
Total:11.1114
Area:622.839
Solvation:-4.45953
Coulombic:-54.161
Bond Count [?]
All:30
Single:19
Double:11
Rotors:9
Chiral:0
Rigid Segments:7
Chemical Properties
Molecular Weight:374.432
H-Bond Donors:2
H-Bond Acceptors:5
XLogP:4.93
LogP (Chemaxon):3.91

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Descriptor Annotations

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