ChemDB: Chemical Search
Download
Chemical ID: 7432360
Chemical ID:
7432360
Name [?]:
4-(4-fluorophenyl)-3,6-diphenyl-pyridazine
SMILES [?]:
c1ccc(cc1)c2cc(c(nn2)c3ccccc3)c4ccc(cc4)F
InChi [?]:
InChI=1/C22H15FN2/c23-19-13-11-16(12-14-19)20-15-21(17-7-3-1-4-8-17)24-25-22(20)18-9-5-2-6-10-18/h1-15H
InChi Info:
AuxInfo=1/0/N:1,16,2,6,15,17,3,5,14,18,20,24,21,23,8,19,4,13,22,9,7,10,25,12,11/E:(3,4)(5,6)(7,8)(9,10)(11,12)(13,14)/rA:25nCCCCCCCCCCNNCCCCCCCCCCCCF/rB:s1;d2;s3;d4;d1s5;s4;s7;d8;s9;d10;d7s11;s10;s13;d14;s15;d16;d13s17;s9;s19;d20;s21;d22;d19s23;s22;/rC:;;;;;;;;;;;;;;;;;;;;;;;;;
Chemical Details
Atom Count
Formula: | C22H15FN2 |
All Atoms: | 40 |
Heavy Atoms: | 25 |
Chiral Atoms: | 0 |
ZAP Information [?]
Total: | 10.0379 |
Area: | 513.107 |
Solvation: | -2.7898 |
Coulombic: | -12.1588 |
Bond Count [?]
All: | 28 |
Single: | 16 |
Double: | 12 |
Rotors: | 3 |
Chiral: | 0 |
Rigid Segments: | 4 |
Chemical Properties
Molecular Weight: | 326.366 |
H-Bond Donors: | 0 |
H-Bond Acceptors: | 0 |
XLogP: | 6.1 |
LogP (Chemaxon): | 5.4 |
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 |
---|