Chemical ID: 5358299

CC(=O)c1cc(ccc1OCC(=O)Nc2ccc(c(c2)Cl)F)Cl
Chemical ID:
5358299
Name [?]:
2-(2-acetyl-4-chloro-phenoxy)-N-(3-chloro-4-fluoro-phenyl)-acetamide
SMILES [?]:
CC(=O)c1cc(ccc1OCC(=O)Nc2ccc(c(c2)Cl)F)Cl
InChi [?]:
InChI=1/C16H12Cl2FNO3/c1-9(21)12-6-10(17)2-5-15(12)23-8-16(22)20-11-3-4-14(19)13(18)7-11/h2-7H,8H2,1H3,(H,20,22)
InChi Info:
AuxInfo=1/1/N:1,7,16,17,8,5,20,11,2,6,15,4,19,18,9,12,23,21,22,14,3,13,10/rA:23nCCOCCCCCCOCCONCCCCCCClFCl/rB:s1;d2;s2;s4;d5;s6;d7;d4s8;s9;s10;s11;d12;s12;s14;s15;d16;s17;d18;d15s19;s19;s18;s6;/rC:;;;;;;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C16H12Cl2FNO3
All Atoms:23
Heavy Atoms:23
Chiral Atoms:0
ZAP Information [?]
Total:6.29691
Area:542.217
Solvation:-7.25852
Coulombic:-36.6491
Bond Count [?]
All:24
Single:16
Double:8
Rotors:6
Chiral:0
Rigid Segments:5
Chemical Properties
Molecular Weight:356.175
H-Bond Donors:1
H-Bond Acceptors:4
XLogP:3.92
LogP (Chemaxon):3.36

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