C41H32N2 — CID 59195172
5,10-dimethyl-2-[2-methyl-10-(4-phenylphenyl)anthracen-9-yl]phenazine (PubChem CID 59195172) has the molecular formula C41H32N2 and a molecular weight of 552.72 g/mol. Its IUPAC name is 5,10-dimethyl-2-[2-methyl-10-(4-phenylphenyl)anthracen-9-yl]phenazine.
| Compound Name | 5,10-dimethyl-2-[2-methyl-10-(4-phenylphenyl)anthracen-9-yl]phenazine |
|---|---|
| PubChem CID | 59195172 |
| Molecular Formula | C41H32N2 |
| Molecular Weight | 552.72 g/mol |
| Exact Mass | 552.26 |
| IUPAC Name | 5,10-dimethyl-2-[2-methyl-10-(4-phenylphenyl)anthracen-9-yl]phenazine |
| SMILES | Cc1ccc2c(-c3ccc(-c4ccccc4)cc3)c3ccccc3c(-c3ccc4c(c3)N(C)c3ccccc3N4C)c2c1 |
| InChI | InChI=1S/C41H32N2/c1-27-17-23-34-35(25-27)41(31-22-24-38-39(26-31)43(3)37-16-10-9-15-36(37)42(38)2)33-14-8-7-13-32(33)40(34)30-20-18-29(19-21-30)28-11-5-4-6-12-28/h4-26H,1-3H3 |
| InChIKey | ZIQADBSFRKKNIZ-UHFFFAOYSA-N |
| XLogP | 11.15 |
| TPSA | 6.48 Ų |
| H-Bond Donors | |
| H-Bond Acceptors | 2 |
| Rotatable Bonds | 3 |
| Heavy Atoms | 43 |
| Complexity | — |
2 violations
| Rule | Value |
|---|---|
| MW ≤ 500 | 552.72 |
| LogP ≤ 5 | 11.15 |
| H-Bond Donors ≤ 5 | 0 |
| H-Bond Acceptors ≤ 10 | 2 |
| Structural Alerts | {'alert_name': 'Polycyclic_aromatic_hydrocarbon_2', 'substructure': 'N/A'} |
|---|