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Chemical ID: 7514213

Chemical ID:

7514213

Name [?]:

N-(4-methoxyphenyl)-5-(p-tolylmethyl)furan-2-carboxamide

SMILES [?]:

Cc1ccc(cc1)Cc2ccc(o2)C(=O)Nc3ccc(cc3)OC

InChi [?]:

InChI=1/C20H19NO3/c1-14-3-5-15(6-4-14)13-18-11-12-19(24-18)20(22)21-16-7-9-17(23-2)10-8-16/h3-12H,13H2,1-2H3,(H,21,22)

InChi Info:

AuxInfo=1/1/N:1,24,3,7,4,6,18,22,19,21,10,11,8,2,5,17,20,9,12,14,16,15,23,13/E:(3,4)(5,6)(7,8)(9,10)/rA:24nCCCCCCCCCCCCOCONCCCCCCOC/rB:s1;s2;d3;s4;d5;d2s6;s5;s8;d9;s10;d11;s9s12;s12;d14;s14;s16;s17;d18;s19;d20;d17s21;s20;s23;/rC:;;;;;;;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count

Formula:	C₂₀H₁₉NO₃
All Atoms:	43
Heavy Atoms:	24
Chiral Atoms:	None

ZAP Information [?]

Total:	10.1549
Area:	551.908
Solvation:	-3.6428
Coulombic:	-38.7363

Bond Count [?]

All:	26
Single:	17
Double:	9
Rotors:	6
Chiral:	None
Rigid Segments:	None

Chemical Properties

Molecular Weight:	None
H-Bond Donors:	None
H-Bond Acceptors:	None
XLogP:	3.81
LogP (Chemaxon):	None

Name Annotations

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Chemical	Mix Source	External ID	Descriptor	Value

Experimental Annotations

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Chemical Mix	Source	External ID	Descriptor	Value

Descriptor Annotations

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Chemical Mix	Source	External ID	Descriptor	Value