Chemical ID: 4202872

COc1ccccc1CNC(=O)C(=O)NCc2ccccc2
Chemical ID:
4202872
Name [?]:
N'-benzyl-N-[(2-methoxyphenyl)methyl]oxamide
SMILES [?]:
COc1ccccc1CNC(=O)C(=O)NCc2ccccc2
InChi [?]:
InChI=1/C17H18N2O3/c1-22-15-10-6-5-9-14(15)12-19-17(21)16(20)18-11-13-7-3-2-4-8-13/h2-10H,11-12H2,1H3,(H,18,20)(H,19,21)
InChi Info:
AuxInfo=1/1/N:1,20,19,21,6,5,18,22,7,4,16,9,17,8,3,13,11,15,10,14,12,2/E:(3,4)(7,8)/rA:22nCOCCCCCCCNCOCONCCCCCCC/rB:s1;s2;s3;d4;s5;d6;d3s7;s8;s9;s10;d11;s11;d13;s13;s15;s16;s17;d18;s19;d20;d17s21;/rC:;;;;;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C17H18N2O3
All Atoms:22
Heavy Atoms:22
Chiral Atoms:0
ZAP Information [?]
Total:9.99414
Area:531.355
Solvation:-3.28974
Coulombic:-56.6074
Bond Count [?]
All:23
Single:15
Double:8
Rotors:8
Chiral:0
Rigid Segments:7
Chemical Properties
Molecular Weight:298.336
H-Bond Donors:2
H-Bond Acceptors:5
XLogP:2.23
LogP (Chemaxon):1.82

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Descriptor Annotations

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