Chemical ID: 6032194

c1ccc(cc1)CNC(=O)CCN(Cc2ccco2)C(=O)c3ccoc3
Chemical ID:
6032194
Name [?]:
N-[2-(benzylcarbamoyl)ethyl]-N-(2-furylmethyl)furan-3-carboxamide
SMILES [?]:
c1ccc(cc1)CNC(=O)CCN(Cc2ccco2)C(=O)c3ccoc3
InChi [?]:
InChI=1/C20H20N2O4/c23-19(21-13-16-5-2-1-3-6-16)8-10-22(14-18-7-4-11-26-18)20(24)17-9-12-25-15-17/h1-7,9,11-12,15H,8,10,13-14H2,(H,21,23)
InChi Info:
AuxInfo=1/1/N:1,2,6,17,3,5,16,11,23,12,18,24,7,14,26,4,22,15,9,20,8,13,10,21,25,19/E:(2,3)(5,6)/rA:26nCCCCCCCNCOCCNCCCCCOCOCCCOC/rB:s1;d2;s3;d4;d1s5;s4;s7;s8;d9;s9;s11;s12;s13;s14;d15;s16;d17;s15s18;s13;d20;s20;s22;d23;s24;d22s25;/rC:;;;;;;;;;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C20H20N2O4
All Atoms:26
Heavy Atoms:26
Chiral Atoms:0
ZAP Information [?]
Total:9.75482
Area:583.402
Solvation:-4.83023
Coulombic:-51.439
Bond Count [?]
All:28
Single:19
Double:9
Rotors:10
Chiral:0
Rigid Segments:7
Chemical Properties
Molecular Weight:352.384
H-Bond Donors:1
H-Bond Acceptors:4
XLogP:1.62
LogP (Chemaxon):1.98

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Descriptor Annotations

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