C157H123N13 — CID 157103657
10-[4-[4-[4-(9,9-dimethylacridin-10-yl)phenyl]-6-[4-(10,10-dimethyl-9H-anthracen-9-yl)phenyl]-1,3,5-triazin-2-yl]phenyl]-9,9-dimethylacridine;9,9-dimethyl-10-[4-[4-phenyl-6-(3-phenylphenyl)-1,3,5-triazin-2-yl]phenyl]acridine;10-[4-[4-(3,5-diphenylphenyl)-6-phenyl-1,3,5-triazin-2-yl]phenyl]-9,9-dimethylacridine (PubChem CID 157103657) has the molecular formula C157H123N13 and a molecular weight of 2191.80 g/mol. Its IUPAC name is 10-[4-[4-[4-(9,9-dimethylacridin-10-yl)phenyl]-6-[4-(10,10-dimethyl-9H-anthracen-9-yl)phenyl]-1,3,5-triazin-2-yl]phenyl]-9,9-dimethylacridine;9,9-dimethyl-10-[4-[4-phenyl-6-(3-phenylphenyl)-1,3,5-triazin-2-yl]phenyl]acridine;10-[4-[4-(3,5-diphenylphenyl)-6-phenyl-1,3,5-triazin-2-yl]phenyl]-9,9-dimethylacridine.
| Compound Name | 10-[4-[4-[4-(9,9-dimethylacridin-10-yl)phenyl]-6-[4-(10,10-dimethyl-9H-anthracen-9-yl)phenyl]-1,3,5-triazin-2-yl]phenyl]-9,9-dimethylacridine;9,9-dimethyl-10-[4-[4-phenyl-6-(3-phenylphenyl)-1,3,5-triazin-2-yl]phenyl]acridine;10-[4-[4-(3,5-diphenylphenyl)-6-phenyl-1,3,5-triazin-2-yl]phenyl]-9,9-dimethylacridine |
|---|---|
| PubChem CID | 157103657 |
| Molecular Formula | C157H123N13 |
| Molecular Weight | 2191.80 g/mol |
| Exact Mass | 2190.00 |
| IUPAC Name | 10-[4-[4-[4-(9,9-dimethylacridin-10-yl)phenyl]-6-[4-(10,10-dimethyl-9H-anthracen-9-yl)phenyl]-1,3,5-triazin-2-yl]phenyl]-9,9-dimethylacridine;9,9-dimethyl-10-[4-[4-phenyl-6-(3-phenylphenyl)-1,3,5-triazin-2-yl]phenyl]acridine;10-[4-[4-(3,5-diphenylphenyl)-6-phenyl-1,3,5-triazin-2-yl]phenyl]-9,9-dimethylacridine |
| SMILES | CC1(C)c2ccccc2C(c2ccc(-c3nc(-c4ccc(N5c6ccccc6C(C)(C)c6ccccc65)cc4)nc(-c4ccc(N5c6ccccc6C(C)(C)c6ccccc65)cc4)n3)cc2)c2ccccc21.CC1(C)c2ccccc2N(c2ccc(-c3nc(-c4ccccc4)nc(-c4cc(-c5ccccc5)cc(-c5ccccc5)c4)n3)cc2)c2ccccc21.CC1(C)c2ccccc2N(c2ccc(-c3nc(-c4ccccc4)nc(-c4cccc(-c5ccccc5)c4)n3)cc2)c2ccccc21 |
| InChI | InChI=1S/C67H55N5.C48H36N4.C42H32N4/c1-65(2)51-21-9-7-19-49(51)61(50-20-8-10-22-52(50)65)43-31-33-44(34-32-43)62-68-63(45-35-39-47(40-36-45)71-57-27-15-11-23-53(57)66(3,4)54-24-12-16-28-58(54)71)70-64(69-62)46-37-41-48(42-38-46)72-59-29-17-13-25-55(59)67(5,6)56-26-14-18-30-60(56)72;1-48(2)41-22-12-14-24-43(41)52(44-25-15-13-23-42(44)48)40-28-26-36(27-29-40)46-49-45(35-20-10-5-11-21-35)50-47(51-46)39-31-37(33-16-6-3-7-17-33)30-38(32-39)34-18-8-4-9-19-34;1-42(2)35-20-9-11-22-37(35)46(38-23-12-10-21-36(38)42)34-26-24-31(25-27-34)40-43-39(30-16-7-4-8-17-30)44-41(45-40)33-19-13-18-32(28-33)29-14-5-3-6-15-29/h7-42,61H,1-6H3;3-32H,1-2H3;3-28H,1-2H3 |
| InChIKey | AGBAMAFUIMUFLA-UHFFFAOYSA-N |
| XLogP | 39.87 |
| TPSA | 128.97 Ų |
| H-Bond Donors | |
| H-Bond Acceptors | 13 |
| Rotatable Bonds | 17 |
| Heavy Atoms | 170 |
| Complexity | — |
3 violations
| Rule | Value |
|---|---|
| MW ≤ 500 | 2191.80 |
| LogP ≤ 5 | 39.87 |
| H-Bond Donors ≤ 5 | 0 |
| H-Bond Acceptors ≤ 10 | 13 |