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Chemical ID: 4149160

Chemical ID:

4149160

Name [?]:

N-(4-fluorophenyl)-2-(4-phenylphenoxy)-acetamide

SMILES [?]:

c1ccc(cc1)c2ccc(cc2)OCC(=O)Nc3ccc(cc3)F

InChi [?]:

InChI=1/C20H16FNO2/c21-17-8-10-18(11-9-17)22-20(23)14-24-19-12-6-16(7-13-19)15-4-2-1-3-5-15/h1-13H,14H2,(H,22,23)

InChi Info:

AuxInfo=1/1/N:1,2,6,3,5,8,12,20,22,19,23,9,11,14,4,7,21,18,10,15,24,17,16,13/E:(2,3)(4,5)(6,7)(8,9)(10,11)(12,13)/rA:24nCCCCCCCCCCCCOCCONCCCCCCF/rB:s1;d2;s3;d4;d1s5;s4;s7;d8;s9;d10;d7s11;s10;s13;s14;d15;s15;s17;s18;d19;s20;d21;d18s22;s21;/rC:;;;;;;;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count

Formula:	C₂₀H₁₆FNO₂
All Atoms:	24
Heavy Atoms:	24
Chiral Atoms:	0

ZAP Information [?]

Total:	8.26248
Area:	535.197
Solvation:	-5.11745
Coulombic:	-33.6646

Bond Count [?]

All:	26
Single:	16
Double:	10
Rotors:	6
Chiral:	0
Rigid Segments:	5

Chemical Properties

Molecular Weight:	321.345
H-Bond Donors:	1
H-Bond Acceptors:	3
XLogP:	4.78
LogP (Chemaxon):	4.7

Name Annotations

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Chemical	Mix Source	External ID	Descriptor	Value

Experimental Annotations

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Descriptor Annotations

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Chemical Mix	Source	External ID	Descriptor	Value