C192H118N12O3S — CID 164978875
2,4-dinaphthalen-1-yl-6-[8-(5-phenylnaphthalen-2-yl)dibenzofuran-2-yl]-1,3,5-triazine;2-naphthalen-2-yl-4-[9-(3-naphthalen-2-ylphenyl)dibenzothiophen-2-yl]-6-phenyl-1,3,5-triazine;2-naphthalen-2-yl-4-phenyl-6-[3-(6-phenylnaphthalen-2-yl)dibenzofuran-2-yl]-1,3,5-triazine;2-naphthalen-2-yl-4-phenyl-6-[8-(6-phenylnaphthalen-2-yl)dibenzofuran-2-yl]-1,3,5-triazine (PubChem CID 164978875) has the molecular formula C192H118N12O3S and a molecular weight of 2673.20 g/mol. Its IUPAC name is 2,4-dinaphthalen-1-yl-6-[8-(5-phenylnaphthalen-2-yl)dibenzofuran-2-yl]-1,3,5-triazine;2-naphthalen-2-yl-4-[9-(3-naphthalen-2-ylphenyl)dibenzothiophen-2-yl]-6-phenyl-1,3,5-triazine;2-naphthalen-2-yl-4-phenyl-6-[3-(6-phenylnaphthalen-2-yl)dibenzofuran-2-yl]-1,3,5-triazine;2-naphthalen-2-yl-4-phenyl-6-[8-(6-phenylnaphthalen-2-yl)dibenzofuran-2-yl]-1,3,5-triazine.
| Compound Name | 2,4-dinaphthalen-1-yl-6-[8-(5-phenylnaphthalen-2-yl)dibenzofuran-2-yl]-1,3,5-triazine;2-naphthalen-2-yl-4-[9-(3-naphthalen-2-ylphenyl)dibenzothiophen-2-yl]-6-phenyl-1,3,5-triazine;2-naphthalen-2-yl-4-phenyl-6-[3-(6-phenylnaphthalen-2-yl)dibenzofuran-2-yl]-1,3,5-triazine;2-naphthalen-2-yl-4-phenyl-6-[8-(6-phenylnaphthalen-2-yl)dibenzofuran-2-yl]-1,3,5-triazine |
|---|---|
| PubChem CID | 164978875 |
| Molecular Formula | C192H118N12O3S |
| Molecular Weight | 2673.20 g/mol |
| Exact Mass | 2670.92 |
| IUPAC Name | 2,4-dinaphthalen-1-yl-6-[8-(5-phenylnaphthalen-2-yl)dibenzofuran-2-yl]-1,3,5-triazine;2-naphthalen-2-yl-4-[9-(3-naphthalen-2-ylphenyl)dibenzothiophen-2-yl]-6-phenyl-1,3,5-triazine;2-naphthalen-2-yl-4-phenyl-6-[3-(6-phenylnaphthalen-2-yl)dibenzofuran-2-yl]-1,3,5-triazine;2-naphthalen-2-yl-4-phenyl-6-[8-(6-phenylnaphthalen-2-yl)dibenzofuran-2-yl]-1,3,5-triazine |
| SMILES | c1ccc(-c2ccc3cc(-c4cc5oc6ccccc6c5cc4-c4nc(-c5ccccc5)nc(-c5ccc6ccccc6c5)n4)ccc3c2)cc1.c1ccc(-c2ccc3cc(-c4ccc5oc6ccc(-c7nc(-c8ccccc8)nc(-c8ccc9ccccc9c8)n7)cc6c5c4)ccc3c2)cc1.c1ccc(-c2cccc3cc(-c4ccc5oc6ccc(-c7nc(-c8cccc9ccccc89)nc(-c8cccc9ccccc89)n7)cc6c5c4)ccc23)cc1.c1ccc(-c2nc(-c3ccc4ccccc4c3)nc(-c3ccc4sc5cccc(-c6cccc(-c7ccc8ccccc8c7)c6)c5c4c3)n2)cc1 |
| InChI | InChI=1S/C51H31N3O.2C47H29N3O.C47H29N3S/c1-2-11-32(12-3-1)39-20-10-17-37-29-35(23-26-42(37)39)36-24-27-47-45(30-36)46-31-38(25-28-48(46)55-47)49-52-50(43-21-8-15-33-13-4-6-18-40(33)43)54-51(53-49)44-22-9-16-34-14-5-7-19-41(34)44;1-3-11-30(12-4-1)34-20-21-36-26-37(23-22-35(36)25-34)40-29-44-41(39-17-9-10-18-43(39)51-44)28-42(40)47-49-45(32-14-5-2-6-15-32)48-46(50-47)38-24-19-31-13-7-8-16-33(31)27-38;1-3-9-30(10-4-1)34-16-17-36-26-37(19-18-35(36)25-34)38-21-23-43-41(28-38)42-29-40(22-24-44(42)51-43)47-49-45(32-12-5-2-6-13-32)48-46(50-47)39-20-15-31-11-7-8-14-33(31)27-39;1-2-12-32(13-3-1)45-48-46(38-23-21-31-11-5-7-15-34(31)28-38)50-47(49-45)39-24-25-42-41(29-39)44-40(18-9-19-43(44)51-42)37-17-8-16-35(27-37)36-22-20-30-10-4-6-14-33(30)26-36/h1-31H;3*1-29H |
| InChIKey | FEKBJEMBGDHHPE-UHFFFAOYSA-N |
| XLogP | 51.27 |
| TPSA | 194.10 Ų |
| H-Bond Donors | |
| H-Bond Acceptors | 16 |
| Rotatable Bonds | 20 |
| Heavy Atoms | 208 |
| Complexity | — |
3 violations
| Rule | Value |
|---|---|
| MW ≤ 500 | 2673.20 |
| LogP ≤ 5 | 51.27 |
| H-Bond Donors ≤ 5 | 0 |
| H-Bond Acceptors ≤ 10 | 16 |