ChemDB: Chemical Search
Download
Chemical ID: 4143699
Chemical ID:
4143699
Name [?]:
2-(2-chlorophenoxy)-N-(2-fluorophenyl)-acetamide
SMILES [?]:
c1ccc(c(c1)NC(=O)COc2ccccc2Cl)F
InChi [?]:
InChI=1/C14H11ClFNO2/c15-10-5-1-4-8-13(10)19-9-14(18)17-12-7-3-2-6-11(12)16/h1-8H,9H2,(H,17,18)
InChi Info:
AuxInfo=1/1/N:15,2,1,14,16,3,6,13,10,17,4,5,12,8,18,19,7,9,11/rA:19nCCCCCCNCOCOCCCCCCClF/rB:s1;d2;s3;d4;d1s5;s5;s7;d8;s8;s10;s11;s12;d13;s14;d15;d12s16;s17;s4;/rC:;;;;;;;;;;;;;;;;;;;
Chemical Details
Atom Count
Formula: | C14H11ClFNO2 |
All Atoms: | 19 |
Heavy Atoms: | 19 |
Chiral Atoms: | 0 |
ZAP Information [?]
Total: | 6.99447 |
Area: | 458.177 |
Solvation: | -4.45994 |
Coulombic: | -33.9568 |
Bond Count [?]
All: | 20 |
Single: | 13 |
Double: | 7 |
Rotors: | 5 |
Chiral: | 0 |
Rigid Segments: | 4 |
Chemical Properties
Molecular Weight: | 279.694 |
H-Bond Donors: | 1 |
H-Bond Acceptors: | 3 |
XLogP: | 3.46 |
LogP (Chemaxon): | 2.88 |
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 |
---|