Chemical ID: 7038149

COc1cccc(c1)C(NC(=O)c2ccccc2)NC(=O)c3ccccc3
Chemical ID:
7038149
Name [?]:
N-[benzamido-(3-methoxyphenyl)-methyl]benzamide
SMILES [?]:
COc1cccc(c1)C(NC(=O)c2ccccc2)NC(=O)c3ccccc3
InChi [?]:
InChI=1/C22H20N2O3/c1-27-19-14-8-13-18(15-19)20(23-21(25)16-9-4-2-5-10-16)24-22(26)17-11-6-3-7-12-17/h2-15,20H,1H3,(H,23,25)(H,24,26)
InChi Info:
AuxInfo=1/1/N:1,16,25,15,17,24,26,5,14,18,23,27,6,4,8,13,22,7,3,9,11,20,10,19,12,21,2/E:(2,3)(4,5,6,7)(9,10,11,12)(16,17)(21,22)(23,24)(25,26)/gE:(1,2)/rA:27nCOCCCCCCCNCOCCCCCCNCOCCCCCC/rB:s1;s2;s3;d4;s5;d6;d3s7;s7;s9;s10;d11;s11;s13;d14;s15;d16;d13s17;s9;s19;d20;s20;s22;d23;s24;d25;d22s26;/rC:;;;;;;;;;;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C22H20N2O3
All Atoms:47
Heavy Atoms:27
Chiral Atoms:0
ZAP Information [?]
Total:10.3561
Area:596.603
Solvation:-4.55901
Coulombic:-53.8963
Bond Count [?]
All:29
Single:18
Double:11
Rotors:8
Chiral:0
Rigid Segments:7
Chemical Properties
Molecular Weight:360.406
H-Bond Donors:2
H-Bond Acceptors:5
XLogP:4.51
LogP (Chemaxon):3.57

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Descriptor Annotations

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