ChemDB: Chemical Search
Download
Chemical ID: 7370670
Chemical ID:
7370670
Name [?]:
3,5-dichloro-N-(3,4-difluorophenyl)-4-hydroxy-benzamide
SMILES [?]:
c1cc(c(cc1NC(=O)c2cc(c(c(c2)Cl)O)Cl)F)F
InChi [?]:
InChI=1/C13H7Cl2F2NO2/c14-8-3-6(4-9(15)12(8)19)13(20)18-7-1-2-10(16)11(17)5-7/h1-5,19H,(H,18,20)
InChi Info:
AuxInfo=1/1/N:1,2,11,15,5,10,6,12,14,3,4,13,8,18,16,20,19,7,17,9/E:(3,4)(8,9)(14,15)/rA:20nCCCCCCNCOCCCCCCClOClFF/rB:s1;d2;s3;d4;d1s5;s6;s7;d8;s8;s10;d11;s12;d13;d10s14;s14;s13;s12;s4;s3;/rC:;;;;;;;;;;;;;;;;;;;;
Chemical Details
Atom Count
Formula: | C13H7Cl2F2NO2 |
All Atoms: | 27 |
Heavy Atoms: | 20 |
Chiral Atoms: | 0 |
ZAP Information [?]
Total: | 7.12888 |
Area: | 471.863 |
Solvation: | -4.66769 |
Coulombic: | -44.4324 |
Bond Count [?]
All: | 21 |
Single: | 14 |
Double: | 7 |
Rotors: | 3 |
Chiral: | 0 |
Rigid Segments: | 3 |
Chemical Properties
Molecular Weight: | 318.102 |
H-Bond Donors: | 2 |
H-Bond Acceptors: | 3 |
XLogP: | 4.15 |
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 |
---|