C36H24N4 — CID 146542668
5-[2-[3-(10-phenylphenazin-5-yl)phenyl]phenyl]pyridine-3-carbonitrile (PubChem CID 146542668) has the molecular formula C36H24N4 and a molecular weight of 512.62 g/mol. Its IUPAC name is 5-[2-[3-(10-phenylphenazin-5-yl)phenyl]phenyl]pyridine-3-carbonitrile.
| Compound Name | 5-[2-[3-(10-phenylphenazin-5-yl)phenyl]phenyl]pyridine-3-carbonitrile |
|---|---|
| PubChem CID | 146542668 |
| Molecular Formula | C36H24N4 |
| Molecular Weight | 512.62 g/mol |
| Exact Mass | 512.20 |
| IUPAC Name | 5-[2-[3-(10-phenylphenazin-5-yl)phenyl]phenyl]pyridine-3-carbonitrile |
| SMILES | N#Cc1cncc(-c2ccccc2-c2cccc(N3c4ccccc4N(c4ccccc4)c4ccccc43)c2)c1 |
| InChI | InChI=1S/C36H24N4/c37-23-26-21-28(25-38-24-26)32-16-5-4-15-31(32)27-11-10-14-30(22-27)40-35-19-8-6-17-33(35)39(29-12-2-1-3-13-29)34-18-7-9-20-36(34)40/h1-22,24-25H |
| InChIKey | OLTANPHPGYWQCD-UHFFFAOYSA-N |
| XLogP | 9.54 |
| TPSA | 43.16 Ų |
| H-Bond Donors | |
| H-Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Heavy Atoms | 40 |
| Complexity | — |
2 violations
| Rule | Value |
|---|---|
| MW ≤ 500 | 512.62 |
| LogP ≤ 5 | 9.54 |
| H-Bond Donors ≤ 5 | 0 |
| H-Bond Acceptors ≤ 10 | 4 |