C188H145N3 — CID 159070020
N-[9,9-dimethyl-7-(4-phenylphenyl)fluoren-2-yl]-9,9-dimethyl-N-(4-naphthalen-1-ylphenyl)-7-phenylfluoren-2-amine;N-[9,9-dimethyl-7-(4-phenylphenyl)fluoren-2-yl]-9,9-dimethyl-N-(4-naphthalen-2-ylphenyl)-7-phenylfluoren-2-amine;N-[9,9-dimethyl-7-(4-phenylphenyl)fluoren-2-yl]-9,9-dimethyl-7-phenyl-N-(4-phenylphenyl)fluoren-2-amine (PubChem CID 159070020) has the molecular formula C188H145N3 and a molecular weight of 2446.25 g/mol. Its IUPAC name is N-[9,9-dimethyl-7-(4-phenylphenyl)fluoren-2-yl]-9,9-dimethyl-N-(4-naphthalen-1-ylphenyl)-7-phenylfluoren-2-amine;N-[9,9-dimethyl-7-(4-phenylphenyl)fluoren-2-yl]-9,9-dimethyl-N-(4-naphthalen-2-ylphenyl)-7-phenylfluoren-2-amine;N-[9,9-dimethyl-7-(4-phenylphenyl)fluoren-2-yl]-9,9-dimethyl-7-phenyl-N-(4-phenylphenyl)fluoren-2-amine.
| Compound Name | N-[9,9-dimethyl-7-(4-phenylphenyl)fluoren-2-yl]-9,9-dimethyl-N-(4-naphthalen-1-ylphenyl)-7-phenylfluoren-2-amine;N-[9,9-dimethyl-7-(4-phenylphenyl)fluoren-2-yl]-9,9-dimethyl-N-(4-naphthalen-2-ylphenyl)-7-phenylfluoren-2-amine;N-[9,9-dimethyl-7-(4-phenylphenyl)fluoren-2-yl]-9,9-dimethyl-7-phenyl-N-(4-phenylphenyl)fluoren-2-amine |
|---|---|
| PubChem CID | 159070020 |
| Molecular Formula | C188H145N3 |
| Molecular Weight | 2446.25 g/mol |
| Exact Mass | 2444.14 |
| IUPAC Name | N-[9,9-dimethyl-7-(4-phenylphenyl)fluoren-2-yl]-9,9-dimethyl-N-(4-naphthalen-1-ylphenyl)-7-phenylfluoren-2-amine;N-[9,9-dimethyl-7-(4-phenylphenyl)fluoren-2-yl]-9,9-dimethyl-N-(4-naphthalen-2-ylphenyl)-7-phenylfluoren-2-amine;N-[9,9-dimethyl-7-(4-phenylphenyl)fluoren-2-yl]-9,9-dimethyl-7-phenyl-N-(4-phenylphenyl)fluoren-2-amine |
| SMILES | CC1(C)c2cc(-c3ccccc3)ccc2-c2ccc(N(c3ccc(-c4ccc5ccccc5c4)cc3)c3ccc4c(c3)C(C)(C)c3cc(-c5ccc(-c6ccccc6)cc5)ccc3-4)cc21.CC1(C)c2cc(-c3ccccc3)ccc2-c2ccc(N(c3ccc(-c4cccc5ccccc45)cc3)c3ccc4c(c3)C(C)(C)c3cc(-c5ccc(-c6ccccc6)cc5)ccc3-4)cc21.CC1(C)c2cc(-c3ccccc3)ccc2-c2ccc(N(c3ccc(-c4ccccc4)cc3)c3ccc4c(c3)C(C)(C)c3cc(-c5ccc(-c6ccccc6)cc5)ccc3-4)cc21 |
| InChI | InChI=1S/2C64H49N.C60H47N/c1-63(2)59-38-48(43-16-9-6-10-17-43)28-34-55(59)57-36-32-51(40-61(57)63)65(50-30-26-47(27-31-50)54-21-13-19-46-18-11-12-20-53(46)54)52-33-37-58-56-35-29-49(39-60(56)64(3,4)62(58)41-52)45-24-22-44(23-25-45)42-14-7-5-8-15-42;1-63(2)59-38-50(43-15-9-6-10-16-43)27-33-55(59)57-35-31-53(40-61(57)63)65(52-29-25-47(26-30-52)49-24-23-44-17-11-12-18-48(44)37-49)54-32-36-58-56-34-28-51(39-60(56)64(3,4)62(58)41-54)46-21-19-45(20-22-46)42-13-7-5-8-14-42;1-59(2)55-36-46(42-18-12-7-13-19-42)26-32-51(55)53-34-30-49(38-57(53)59)61(48-28-24-44(25-29-48)41-16-10-6-11-17-41)50-31-35-54-52-33-27-47(37-56(52)60(3,4)58(54)39-50)45-22-20-43(21-23-45)40-14-8-5-9-15-40/h2*5-41H,1-4H3;5-39H,1-4H3 |
| InChIKey | JZNJZIGSYSAIEA-UHFFFAOYSA-N |
| XLogP | 51.62 |
| TPSA | 9.72 Ų |
| H-Bond Donors | |
| H-Bond Acceptors | 3 |
| Rotatable Bonds | 21 |
| Heavy Atoms | 191 |
| Complexity | — |
2 violations
| Rule | Value |
|---|---|
| MW ≤ 500 | 2446.25 |
| LogP ≤ 5 | 51.62 |
| H-Bond Donors ≤ 5 | 0 |
| H-Bond Acceptors ≤ 10 | 3 |