Chemical ID: 7316772

Cc1ccc2c(c1)occ2CC(=O)Nc3ccc(cc3Cl)F
Chemical ID:
7316772
Name [?]:
N-(2-chloro-4-fluoro-phenyl)-2-(6-methylbenzofuran-3-yl)-acetamide
SMILES [?]:
Cc1ccc2c(c1)occ2CC(=O)Nc3ccc(cc3Cl)F
InChi [?]:
InChI=1/C17H13ClFNO2/c1-10-2-4-13-11(9-22-16(13)6-10)7-17(21)20-15-5-3-12(19)8-14(15)18/h2-6,8-9H,7H2,1H3,(H,20,21)
InChi Info:
AuxInfo=1/1/N:1,3,17,4,16,7,11,19,9,2,10,18,5,20,15,6,12,21,22,14,13,8/rA:22nCCCCCCCOCCCCONCCCCCCClF/rB:s1;s2;d3;s4;d5;d2s6;s6;s8;s5d9;s10;s11;d12;s12;s14;s15;d16;s17;d18;d15s19;s20;s18;/rC:;;;;;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C17H13ClFNO2
All Atoms:35
Heavy Atoms:22
Chiral Atoms:0
ZAP Information [?]
Total:8.50354
Area:500.764
Solvation:-4.01557
Coulombic:-30.9053
Bond Count [?]
All:24
Single:16
Double:8
Rotors:4
Chiral:0
Rigid Segments:3
Chemical Properties
Molecular Weight:317.742
H-Bond Donors:1
H-Bond Acceptors:2
XLogP:3.99
LogP (Chemaxon):4.27

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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