Structure
|
|
|
| InChI Key |
SWWRILUGNLIYGG-UHFFFAOYSA-N |
| Smiles |
C1=CC(=CN=C1)C1=NC=CC(=C1)C1=C(N=CC=C1)C1=CN=CC=C1
|
| InChI |
InChI=1S/C20H14N4/c1-4-16(13-21-8-1)19-12-15(7-11-23-19)18-6-3-10-24-20(18)17-5-2-9-22-14-17/h1-14H
|
Physicochemical Descriptors
| Property Name |
Value |
|
| Molecular Formula |
C20H14N4 |
| Molecular Weight |
310.12 |
| AlogP |
4.27 |
| Hydrogen Bond Acceptor |
4.0 |
| Number of Rotational Bond |
3.0 |
| Polar Surface Area |
51.56 |
| Heavy Atoms |
24.0 |
Cross References
| Resources |
Reference |
|
|
CAS NUMBER
|
59697-14-2
|
| NORMAN SUSDAT |
|
