C152H92N12O4 — CID 164953184
2,4-dinaphthalen-1-yl-6-naphtho[2,1-b][1]benzofuran-2-yl-1,3,5-triazine;2-naphthalen-1-yl-4-naphthalen-2-yl-6-naphtho[2,1-b][1]benzofuran-1-yl-1,3,5-triazine;2-naphtho[2,1-b][1]benzofuran-3-yl-4-phenyl-6-(2-phenylphenyl)-1,3,5-triazine;2-naphtho[2,1-b][1]benzofuran-4-yl-4-phenyl-6-(3-phenylphenyl)-1,3,5-triazine (PubChem CID 164953184) has the molecular formula C152H92N12O4 and a molecular weight of 2150.49 g/mol. Its IUPAC name is 2,4-dinaphthalen-1-yl-6-naphtho[2,1-b][1]benzofuran-2-yl-1,3,5-triazine;2-naphthalen-1-yl-4-naphthalen-2-yl-6-naphtho[2,1-b][1]benzofuran-1-yl-1,3,5-triazine;2-naphtho[2,1-b][1]benzofuran-3-yl-4-phenyl-6-(2-phenylphenyl)-1,3,5-triazine;2-naphtho[2,1-b][1]benzofuran-4-yl-4-phenyl-6-(3-phenylphenyl)-1,3,5-triazine.
| Compound Name | 2,4-dinaphthalen-1-yl-6-naphtho[2,1-b][1]benzofuran-2-yl-1,3,5-triazine;2-naphthalen-1-yl-4-naphthalen-2-yl-6-naphtho[2,1-b][1]benzofuran-1-yl-1,3,5-triazine;2-naphtho[2,1-b][1]benzofuran-3-yl-4-phenyl-6-(2-phenylphenyl)-1,3,5-triazine;2-naphtho[2,1-b][1]benzofuran-4-yl-4-phenyl-6-(3-phenylphenyl)-1,3,5-triazine |
|---|---|
| PubChem CID | 164953184 |
| Molecular Formula | C152H92N12O4 |
| Molecular Weight | 2150.49 g/mol |
| Exact Mass | 2148.74 |
| IUPAC Name | 2,4-dinaphthalen-1-yl-6-naphtho[2,1-b][1]benzofuran-2-yl-1,3,5-triazine;2-naphthalen-1-yl-4-naphthalen-2-yl-6-naphtho[2,1-b][1]benzofuran-1-yl-1,3,5-triazine;2-naphtho[2,1-b][1]benzofuran-3-yl-4-phenyl-6-(2-phenylphenyl)-1,3,5-triazine;2-naphtho[2,1-b][1]benzofuran-4-yl-4-phenyl-6-(3-phenylphenyl)-1,3,5-triazine |
| SMILES | c1ccc(-c2cccc(-c3nc(-c4ccccc4)nc(-c4cccc5c4ccc4oc6ccccc6c45)n3)c2)cc1.c1ccc(-c2nc(-c3ccc4c(ccc5oc6ccccc6c54)c3)nc(-c3ccccc3-c3ccccc3)n2)cc1.c1ccc2c(-c3nc(-c4ccc5ccc6oc7ccccc7c6c5c4)nc(-c4cccc5ccccc45)n3)cccc2c1.c1ccc2cc(-c3nc(-c4cccc5ccccc45)nc(-c4cccc5ccc6oc7ccccc7c6c45)n3)ccc2c1 |
| InChI | InChI=1S/2C39H23N3O.2C37H23N3O/c1-3-13-28-24(9-1)11-7-16-30(28)38-40-37(41-39(42-38)31-17-8-12-25-10-2-4-14-29(25)31)27-20-19-26-21-22-35-36(33(26)23-27)32-15-5-6-18-34(32)43-35;1-2-11-27-23-28(20-19-24(27)9-1)37-40-38(30-16-7-12-25-10-3-4-14-29(25)30)42-39(41-37)32-17-8-13-26-21-22-34-36(35(26)32)31-15-5-6-18-33(31)43-34;1-3-11-24(12-4-1)26-15-9-16-27(23-26)36-38-35(25-13-5-2-6-14-25)39-37(40-36)30-19-10-18-29-28(30)21-22-33-34(29)31-17-7-8-20-32(31)41-33;1-3-11-24(12-4-1)28-15-7-8-16-30(28)37-39-35(25-13-5-2-6-14-25)38-36(40-37)27-19-21-29-26(23-27)20-22-33-34(29)31-17-9-10-18-32(31)41-33/h2*1-23H;2*1-23H |
| InChIKey | AUSOWOBVYTXCDW-UHFFFAOYSA-N |
| XLogP | 39.65 |
| TPSA | 207.24 Ų |
| H-Bond Donors | |
| H-Bond Acceptors | 16 |
| Rotatable Bonds | 14 |
| Heavy Atoms | 168 |
| Complexity | — |
3 violations
| Rule | Value |
|---|---|
| MW ≤ 500 | 2150.49 |
| LogP ≤ 5 | 39.65 |
| H-Bond Donors ≤ 5 | 0 |
| H-Bond Acceptors ≤ 10 | 16 |