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Chemical ID: 5044838
Chemical ID:
5044838
Name [?]:
N-(4-ethoxyphenyl)-N'-(2-furylmethyl)oxamide
SMILES [?]:
CCOc1ccc(cc1)NC(=O)C(=O)NCc2ccco2
InChi [?]:
InChI=1/C15H16N2O4/c1-2-20-12-7-5-11(6-8-12)17-15(19)14(18)16-10-13-4-3-9-21-13/h3-9H,2,10H2,1H3,(H,16,18)(H,17,19)
InChi Info:
AuxInfo=1/1/N:1,2,19,18,6,8,5,9,20,16,7,4,17,13,11,15,10,14,12,3,21/E:(5,6)(7,8)/rA:21nCCOCCCCCCNCOCONCCCCCO/rB:s1;s2;s3;s4;d5;s6;d7;d4s8;s7;s10;d11;s11;d13;s13;s15;s16;d17;s18;d19;s17s20;/rC:;;;;;;;;;;;;;;;;;;;;;
Chemical Details
Atom Count
Formula: | C15H16N2O4 |
All Atoms: | 21 |
Heavy Atoms: | 21 |
Chiral Atoms: | 0 |
ZAP Information [?]
Total: | 8.62223 |
Area: | 511.117 |
Solvation: | -4.1557 |
Coulombic: | -60.0068 |
Bond Count [?]
All: | 22 |
Single: | 15 |
Double: | 7 |
Rotors: | 8 |
Chiral: | 0 |
Rigid Segments: | 6 |
Chemical Properties
Molecular Weight: | 288.299 |
H-Bond Donors: | 2 |
H-Bond Acceptors: | 5 |
XLogP: | 1.2 |
LogP (Chemaxon): | 1.5 |
Name Annotations
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Experimental Annotations
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Descriptor Annotations
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