ChemDB: Chemical Search
Download
Chemical ID: 4774057
Chemical ID:
4774057
Name [?]:
N-(4-acetylphenyl)-2-(4-methoxyphenoxy)-acetamide
SMILES [?]:
CC(=O)c1ccc(cc1)NC(=O)COc2ccc(cc2)OC
InChi [?]:
InChI=1/C17H17NO4/c1-12(19)13-3-5-14(6-4-13)18-17(20)11-22-16-9-7-15(21-2)8-10-16/h3-10H,11H2,1-2H3,(H,18,20)
InChi Info:
AuxInfo=1/1/N:1,22,5,9,6,8,17,19,16,20,13,2,4,7,18,15,11,10,3,12,21,14/E:(3,4)(5,6)(7,8)(9,10)/rA:22nCCOCCCCCCNCOCOCCCCCCOC/rB:s1;d2;s2;s4;d5;s6;d7;d4s8;s7;s10;d11;s11;s13;s14;s15;d16;s17;d18;d15s19;s18;s21;/rC:;;;;;;;;;;;;;;;;;;;;;;
Chemical Details
Atom Count
Formula: | C17H17NO4 |
All Atoms: | 22 |
Heavy Atoms: | 22 |
Chiral Atoms: | 0 |
ZAP Information [?]
Total: | 6.65859 |
Area: | 518.489 |
Solvation: | -6.30364 |
Coulombic: | -41.944 |
Bond Count [?]
All: | 23 |
Single: | 15 |
Double: | 8 |
Rotors: | 7 |
Chiral: | 0 |
Rigid Segments: | 6 |
Chemical Properties
Molecular Weight: | 299.321 |
H-Bond Donors: | 1 |
H-Bond Acceptors: | 5 |
XLogP: | 2.43 |
LogP (Chemaxon): | 1.93 |
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 |
---|