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Chemical ID: 7354182

Chemical ID:

7354182

Name [?]:

N-(3-fluoro-4-methyl-phenyl)-2-[4-(3-oxobutyl)phenoxy]-acetamide

SMILES [?]:

Cc1ccc(cc1F)NC(=O)COc2ccc(cc2)CCC(=O)C

InChi [?]:

InChI=1/C19H20FNO3/c1-13-3-8-16(11-18(13)20)21-19(23)12-24-17-9-6-15(7-10-17)5-4-14(2)22/h3,6-11H,4-5,12H2,1-2H3,(H,21,23)

InChi Info:

AuxInfo=1/1/N:1,24,3,21,20,16,18,4,15,19,6,12,2,22,17,5,14,7,10,8,9,23,11,13/E:(6,7)(9,10)/rA:24nCCCCCCCFNCOCOCCCCCCCCCOC/rB:s1;s2;d3;s4;d5;d2s6;s7;s5;s9;d10;s10;s12;s13;s14;d15;s16;d17;d14s18;s17;s20;s21;d22;s22;/rC:;;;;;;;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count

Formula:	C₁₉H₂₀FNO₃
All Atoms:	44
Heavy Atoms:	24
Chiral Atoms:	None

ZAP Information [?]

Total:	7.98682
Area:	562.685
Solvation:	-6.08031
Coulombic:	-38.0563

Bond Count [?]

All:	25
Single:	17
Double:	8
Rotors:	8
Chiral:	None
Rigid Segments:	None

Chemical Properties

Molecular Weight:	None
H-Bond Donors:	None
H-Bond Acceptors:	None
XLogP:	2.92
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