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Chemical ID: 4221846

Chemical ID:

4221846

Name [?]:

N'-(2-furylmethyl)-N-(3-methoxyphenyl)-oxamide

SMILES [?]:

COc1cccc(c1)NC(=O)C(=O)NCc2ccco2

InChi [?]:

InChI=1/C14H14N2O4/c1-19-11-5-2-4-10(8-11)16-14(18)13(17)15-9-12-6-3-7-20-12/h2-8H,9H2,1H3,(H,15,17)(H,16,18)

InChi Info:

AuxInfo=1/1/N:1,5,18,6,4,17,19,8,15,7,3,16,12,10,14,9,13,11,2,20/rA:20nCOCCCCCCNCOCONCCCCCO/rB:s1;s2;s3;d4;s5;d6;d3s7;s7;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:	7.63039
Area:	483.188
Solvation:	-4.4493
Coulombic:	-59.6875

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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Chemical Mix	Source	External ID	Descriptor	Value