ChemDB: Chemical Search
Download
Chemical ID: 6157895
Chemical ID:
6157895
Name [?]:
2-(2,4-dichlorophenoxy)-N-(2-methoxy-4-methyl-phenyl)-acetamide
SMILES [?]:
Cc1ccc(c(c1)OC)NC(=O)COc2ccc(cc2Cl)Cl
InChi [?]:
InChI=1/C16H15Cl2NO3/c1-10-3-5-13(15(7-10)21-2)19-16(20)9-22-14-6-4-11(17)8-12(14)18/h3-8H,9H2,1-2H3,(H,19,20)
InChi Info:
AuxInfo=1/1/N:1,9,3,17,4,16,7,19,13,2,18,20,5,15,6,11,22,21,10,12,8,14/rA:22nCCCCCCCOCNCOCOCCCCCCClCl/rB:s1;s2;d3;s4;d5;d2s6;s6;s8;s5;s10;d11;s11;s13;s14;s15;d16;s17;d18;d15s19;s20;s18;/rC:;;;;;;;;;;;;;;;;;;;;;;
Chemical Details
Atom Count
Formula: | C16H15Cl2NO3 |
All Atoms: | 22 |
Heavy Atoms: | 22 |
Chiral Atoms: | 0 |
ZAP Information [?]
Total: | 8.58676 |
Area: | 545.004 |
Solvation: | -5.03833 |
Coulombic: | -36.5736 |
Bond Count [?]
All: | 23 |
Single: | 16 |
Double: | 7 |
Rotors: | 6 |
Chiral: | 0 |
Rigid Segments: | 5 |
Chemical Properties
Molecular Weight: | 340.201 |
H-Bond Donors: | 1 |
H-Bond Acceptors: | 4 |
XLogP: | 4.27 |
LogP (Chemaxon): | 4.13 |
Name Annotations
Note: All annotations are abbreviated. For more detailed information please download chemical.
Chemical | Mix Source | External ID | Descriptor | Value |
---|
Experimental Annotations
Note: All annotations are abbreviated. For more detailed information please download chemical.
Chemical Mix | Source | External ID | Descriptor | Value |
---|
Descriptor Annotations
Note: All annotations are abbreviated. For more detailed information please download chemical.
Chemical Mix | Source | External ID | Descriptor | Value |
---|