C206H158N6 — CID 160740362
10-methyl-4-[8-(10-methyl-9,9-diphenylacridin-4-yl)-10-(4-phenylnaphthalen-2-yl)anthracen-1-yl]-9,9-diphenylacridine;9,9,10-trimethyl-1-[10-(4-phenylnaphthalen-2-yl)-8-(9,9,10-trimethylacridin-1-yl)anthracen-1-yl]acridine;9,9,10-trimethyl-4-[10-(4-phenylnaphthalen-2-yl)-8-(9,9,10-trimethylacridin-4-yl)anthracen-1-yl]acridine (PubChem CID 160740362) has the molecular formula C206H158N6 and a molecular weight of 2717.57 g/mol. Its IUPAC name is 10-methyl-4-[8-(10-methyl-9,9-diphenylacridin-4-yl)-10-(4-phenylnaphthalen-2-yl)anthracen-1-yl]-9,9-diphenylacridine;9,9,10-trimethyl-1-[10-(4-phenylnaphthalen-2-yl)-8-(9,9,10-trimethylacridin-1-yl)anthracen-1-yl]acridine;9,9,10-trimethyl-4-[10-(4-phenylnaphthalen-2-yl)-8-(9,9,10-trimethylacridin-4-yl)anthracen-1-yl]acridine.
| Compound Name | 10-methyl-4-[8-(10-methyl-9,9-diphenylacridin-4-yl)-10-(4-phenylnaphthalen-2-yl)anthracen-1-yl]-9,9-diphenylacridine;9,9,10-trimethyl-1-[10-(4-phenylnaphthalen-2-yl)-8-(9,9,10-trimethylacridin-1-yl)anthracen-1-yl]acridine;9,9,10-trimethyl-4-[10-(4-phenylnaphthalen-2-yl)-8-(9,9,10-trimethylacridin-4-yl)anthracen-1-yl]acridine |
|---|---|
| PubChem CID | 160740362 |
| Molecular Formula | C206H158N6 |
| Molecular Weight | 2717.57 g/mol |
| Exact Mass | 2715.25 |
| IUPAC Name | 10-methyl-4-[8-(10-methyl-9,9-diphenylacridin-4-yl)-10-(4-phenylnaphthalen-2-yl)anthracen-1-yl]-9,9-diphenylacridine;9,9,10-trimethyl-1-[10-(4-phenylnaphthalen-2-yl)-8-(9,9,10-trimethylacridin-1-yl)anthracen-1-yl]acridine;9,9,10-trimethyl-4-[10-(4-phenylnaphthalen-2-yl)-8-(9,9,10-trimethylacridin-4-yl)anthracen-1-yl]acridine |
| SMILES | CN1c2ccccc2C(C)(C)c2c(-c3cccc4c(-c5cc(-c6ccccc6)c6ccccc6c5)c5cccc(-c6cccc7c6C(C)(C)c6ccccc6N7C)c5cc34)cccc21.CN1c2ccccc2C(C)(C)c2cccc(-c3cccc4c(-c5cc(-c6ccccc6)c6ccccc6c5)c5cccc(-c6cccc7c6N(C)c6ccccc6C7(C)C)c5cc34)c21.CN1c2ccccc2C(c2ccccc2)(c2ccccc2)c2cccc(-c3cccc4c(-c5cc(-c6ccccc6)c6ccccc6c5)c5cccc(-c6cccc7c6N(C)c6ccccc6C7(c6ccccc6)c6ccccc6)c5cc34)c21 |
| InChI | InChI=1S/C82H58N2.2C62H50N2/c1-83-76-50-22-20-46-72(76)81(58-31-10-4-11-32-58,59-33-12-5-13-34-59)74-48-26-44-67(79(74)83)63-40-24-42-65-70(63)54-71-64(41-25-43-66(71)78(65)57-52-56-30-18-19-39-62(56)69(53-57)55-28-8-3-9-29-55)68-45-27-49-75-80(68)84(2)77-51-23-21-47-73(77)82(75,60-35-14-6-15-36-60)61-37-16-7-17-38-61;1-61(2)52-30-12-14-34-56(52)63(5)59-47(28-18-32-54(59)61)43-24-16-26-45-50(43)38-51-44(48-29-19-33-55-60(48)64(6)57-35-15-13-31-53(57)62(55,3)4)25-17-27-46(51)58(45)41-36-40-22-10-11-23-42(40)49(37-41)39-20-8-7-9-21-39;1-61(2)52-30-12-14-32-54(52)63(5)56-34-18-28-47(59(56)61)43-24-16-26-45-50(43)38-51-44(48-29-19-35-57-60(48)62(3,4)53-31-13-15-33-55(53)64(57)6)25-17-27-46(51)58(45)41-36-40-22-10-11-23-42(40)49(37-41)39-20-8-7-9-21-39/h3-54H,1-2H3;2*7-38H,1-6H3 |
| InChIKey | RVMMFMKZQJSHSS-UHFFFAOYSA-N |
| XLogP | 54.00 |
| TPSA | 19.44 Ų |
| H-Bond Donors | |
| H-Bond Acceptors | 6 |
| Rotatable Bonds | 16 |
| Heavy Atoms | 212 |
| Complexity | — |
2 violations
| Rule | Value |
|---|---|
| MW ≤ 500 | 2717.57 |
| LogP ≤ 5 | 54.00 |
| H-Bond Donors ≤ 5 | 0 |
| H-Bond Acceptors ≤ 10 | 6 |
| Structural Alerts | {'alert_name': 'Polycyclic_aromatic_hydrocarbon_2', 'substructure': 'N/A'} |
|---|