ChemDB: Chemical Search
Download
Chemical ID: 6433834
Chemical ID:
6433834
Name [?]:
N-[(2,4-dimethoxyphenyl)methyleneamino]-2-(2-methylphenoxy)-acetamide
SMILES [?]:
Cc1ccccc1OCC(=O)NN=Cc2ccc(cc2OC)OC
InChi [?]:
InChI=1/C18H20N2O4/c1-13-6-4-5-7-16(13)24-12-18(21)20-19-11-14-8-9-15(22-2)10-17(14)23-3/h4-11H,12H2,1-3H3,(H,20,21)
InChi Info:
AuxInfo=1/1/N:1,24,22,4,5,3,6,16,17,19,14,9,2,15,18,7,20,10,13,12,11,23,21,8/rA:24nCCCCCCCOCCONNCCCCCCCOCOC/rB:s1;s2;d3;s4;d5;d2s6;s7;s8;s9;d10;s10;s12;w13;s14;s15;d16;s17;d18;d15s19;s20;s21;s18;s23;/rC:;;;;;;;;;;;;;;;;;;;;;;;;
Chemical Details
Atom Count
Formula: | C18H20N2O4 |
All Atoms: | 24 |
Heavy Atoms: | 24 |
Chiral Atoms: | 0 |
ZAP Information [?]
Total: | 6.28652 |
Area: | 556.723 |
Solvation: | -7.63155 |
Coulombic: | -39.7896 |
Bond Count [?]
All: | 25 |
Single: | 17 |
Double: | 8 |
Rotors: | 8 |
Chiral: | 1 |
Rigid Segments: | 7 |
Chemical Properties
Molecular Weight: | 328.362 |
H-Bond Donors: | 1 |
H-Bond Acceptors: | 6 |
XLogP: | 3.73 |
LogP (Chemaxon): | 2.98 |
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 |
---|