Chemical ID: 4213450

CC(C)c1ccc(cc1)OCC(=O)Nc2ccc(cc2F)F
Chemical ID:
4213450
Name [?]:
N-(2,4-difluorophenyl)-2-(4-isopropylphenoxy)-acetamide
SMILES [?]:
CC(C)c1ccc(cc1)OCC(=O)Nc2ccc(cc2F)F
InChi [?]:
InChI=1/C17H17F2NO2/c1-11(2)12-3-6-14(7-4-12)22-10-17(21)20-16-8-5-13(18)9-15(16)19/h3-9,11H,10H2,1-2H3,(H,20,21)
InChi Info:
AuxInfo=1/1/N:1,3,5,9,17,6,8,16,19,11,2,4,18,7,20,15,12,22,21,14,13,10/E:(1,2)(3,4)(6,7)/rA:22nCCCCCCCCCOCCONCCCCCCFF/rB:s1;s2;s2;s4;d5;s6;d7;d4s8;s7;s10;s11;d12;s12;s14;s15;d16;s17;d18;d15s19;s20;s18;/rC:;;;;;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C17H17F2NO2
All Atoms:22
Heavy Atoms:22
Chiral Atoms:0
ZAP Information [?]
Total:7.50074
Area:500.106
Solvation:-5.00191
Coulombic:-36.3046
Bond Count [?]
All:23
Single:16
Double:7
Rotors:6
Chiral:0
Rigid Segments:5
Chemical Properties
Molecular Weight:305.319
H-Bond Donors:1
H-Bond Acceptors:3
XLogP:4.4
LogP (Chemaxon):3.7

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Descriptor Annotations

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