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Chemical ID: 4108655
Chemical ID:
4108655
Name [?]:
N'-(2-furylmethyl)-N-(2-methoxyphenyl)-oxamide
SMILES [?]:
COc1ccccc1NC(=O)C(=O)NCc2ccco2
InChi [?]:
InChI=1/C14H14N2O4/c1-19-12-7-3-2-6-11(12)16-14(18)13(17)15-9-10-5-4-8-20-10/h2-8H,9H2,1H3,(H,15,17)(H,16,18)
InChi Info:
AuxInfo=1/1/N:1,6,5,18,17,7,4,19,15,16,8,3,12,10,14,9,13,11,2,20/rA:20nCOCCCCCCNCOCONCCCCCO/rB:s1;s2;s3;d4;s5;d6;d3s7;s8;s9;d10;s10;d12;s12;s14;s15;d16;s17;d18;s16s19;/rC:;;;;;;;;;;;;;;;;;;;;
Chemical Details
Atom Count
Formula: | C14H14N2O4 |
All Atoms: | 20 |
Heavy Atoms: | 20 |
Chiral Atoms: | 0 |
ZAP Information [?]
Total: | 7.99764 |
Area: | 479.416 |
Solvation: | -3.98775 |
Coulombic: | -60.8306 |
Bond Count [?]
All: | 21 |
Single: | 14 |
Double: | 7 |
Rotors: | 7 |
Chiral: | 0 |
Rigid Segments: | 6 |
Chemical Properties
Molecular Weight: | 274.272 |
H-Bond Donors: | 2 |
H-Bond Acceptors: | 5 |
XLogP: | 0.78 |
LogP (Chemaxon): | 1.15 |
Name Annotations
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Experimental Annotations
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Descriptor Annotations
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