Chemical ID: 4213696

CCc1ccc(cc1)CNC(=O)C(=O)NCc2ccccc2
Chemical ID:
4213696
Name [?]:
N'-benzyl-N-[(4-ethylphenyl)methyl]oxamide
SMILES [?]:
CCc1ccc(cc1)CNC(=O)C(=O)NCc2ccccc2
InChi [?]:
InChI=1/C18H20N2O2/c1-2-14-8-10-16(11-9-14)13-20-18(22)17(21)19-12-15-6-4-3-5-7-15/h3-11H,2,12-13H2,1H3,(H,19,21)(H,20,22)
InChi Info:
AuxInfo=1/1/N:1,2,20,19,21,18,22,4,8,5,7,16,9,3,17,6,13,11,15,10,14,12/E:(4,5)(6,7)(8,9)(10,11)/rA:22nCCCCCCCCCNCOCONCCCCCCC/rB:s1;s2;s3;d4;s5;d6;d3s7;s6;s9;s10;d11;s11;d13;s13;s15;s16;s17;d18;s19;d20;d17s21;/rC:;;;;;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C18H20N2O2
All Atoms:22
Heavy Atoms:22
Chiral Atoms:0
ZAP Information [?]
Total:11.7117
Area:547.005
Solvation:-1.9634
Coulombic:-50.3123
Bond Count [?]
All:23
Single:15
Double:8
Rotors:8
Chiral:0
Rigid Segments:7
Chemical Properties
Molecular Weight:296.364
H-Bond Donors:2
H-Bond Acceptors:4
XLogP:3.21
LogP (Chemaxon):2.94

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Descriptor Annotations

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