C231H171N9 — CID 158984824
N-(9H-fluoren-2-yl)-N-[4-[4-(4-phenyl-N-(4-phenylphenyl)anilino)phenyl]phenyl]-9H-fluoren-2-amine;N-[4-[4-[4-(4-methylphenyl)-N-[4-(4-methylphenyl)phenyl]anilino]phenyl]phenyl]-4-phenyl-N-(4-phenylphenyl)aniline;2-N-naphthalen-1-yl-2-N-phenyl-7-N,7-N-bis(4-phenylphenyl)-9H-fluorene-2,7-diamine;1-N,1-N,4-N-triphenyl-4-N-[4-(4-phenyl-N-(4-phenylphenyl)anilino)phenyl]benzene-1,4-diamine (PubChem CID 158984824) has the molecular formula C231H171N9 and a molecular weight of 3072.97 g/mol. Its IUPAC name is N-(9H-fluoren-2-yl)-N-[4-[4-(4-phenyl-N-(4-phenylphenyl)anilino)phenyl]phenyl]-9H-fluoren-2-amine;N-[4-[4-[4-(4-methylphenyl)-N-[4-(4-methylphenyl)phenyl]anilino]phenyl]phenyl]-4-phenyl-N-(4-phenylphenyl)aniline;2-N-naphthalen-1-yl-2-N-phenyl-7-N,7-N-bis(4-phenylphenyl)-9H-fluorene-2,7-diamine;1-N,1-N,4-N-triphenyl-4-N-[4-(4-phenyl-N-(4-phenylphenyl)anilino)phenyl]benzene-1,4-diamine.
| Compound Name | N-(9H-fluoren-2-yl)-N-[4-[4-(4-phenyl-N-(4-phenylphenyl)anilino)phenyl]phenyl]-9H-fluoren-2-amine;N-[4-[4-[4-(4-methylphenyl)-N-[4-(4-methylphenyl)phenyl]anilino]phenyl]phenyl]-4-phenyl-N-(4-phenylphenyl)aniline;2-N-naphthalen-1-yl-2-N-phenyl-7-N,7-N-bis(4-phenylphenyl)-9H-fluorene-2,7-diamine;1-N,1-N,4-N-triphenyl-4-N-[4-(4-phenyl-N-(4-phenylphenyl)anilino)phenyl]benzene-1,4-diamine |
|---|---|
| PubChem CID | 158984824 |
| Molecular Formula | C231H171N9 |
| Molecular Weight | 3072.97 g/mol |
| Exact Mass | 3070.37 |
| IUPAC Name | N-(9H-fluoren-2-yl)-N-[4-[4-(4-phenyl-N-(4-phenylphenyl)anilino)phenyl]phenyl]-9H-fluoren-2-amine;N-[4-[4-[4-(4-methylphenyl)-N-[4-(4-methylphenyl)phenyl]anilino]phenyl]phenyl]-4-phenyl-N-(4-phenylphenyl)aniline;2-N-naphthalen-1-yl-2-N-phenyl-7-N,7-N-bis(4-phenylphenyl)-9H-fluorene-2,7-diamine;1-N,1-N,4-N-triphenyl-4-N-[4-(4-phenyl-N-(4-phenylphenyl)anilino)phenyl]benzene-1,4-diamine |
| SMILES | Cc1ccc(-c2ccc(N(c3ccc(-c4ccc(C)cc4)cc3)c3ccc(-c4ccc(N(c5ccc(-c6ccccc6)cc5)c5ccc(-c6ccccc6)cc5)cc4)cc3)cc2)cc1.c1ccc(-c2ccc(N(c3ccc(-c4ccccc4)cc3)c3ccc(-c4ccc(N(c5ccc6c(c5)Cc5ccccc5-6)c5ccc6c(c5)Cc5ccccc5-6)cc4)cc3)cc2)cc1.c1ccc(-c2ccc(N(c3ccc(-c4ccccc4)cc3)c3ccc(N(c4ccccc4)c4ccc(N(c5ccccc5)c5ccccc5)cc4)cc3)cc2)cc1.c1ccc(-c2ccc(N(c3ccc(-c4ccccc4)cc3)c3ccc4c(c3)Cc3cc(N(c5ccccc5)c5cccc6ccccc56)ccc3-4)cc2)cc1 |
| InChI | InChI=1S/C62H44N2.C62H48N2.C54H41N3.C53H38N2/c1-3-11-43(12-4-1)45-19-27-53(28-20-45)63(54-29-21-46(22-30-54)44-13-5-2-6-14-44)55-31-23-47(24-32-55)48-25-33-56(34-26-48)64(57-35-37-61-51(41-57)39-49-15-7-9-17-59(49)61)58-36-38-62-52(42-58)40-50-16-8-10-18-60(50)62;1-45-13-17-49(18-14-45)53-25-37-59(38-26-53)64(60-39-27-54(28-40-60)50-19-15-46(2)16-20-50)62-43-31-56(32-44-62)55-29-41-61(42-30-55)63(57-33-21-51(22-34-57)47-9-5-3-6-10-47)58-35-23-52(24-36-58)48-11-7-4-8-12-48;1-6-16-42(17-7-1)44-26-30-49(31-27-44)57(50-32-28-45(29-33-50)43-18-8-2-9-19-43)54-40-38-53(39-41-54)56(48-24-14-5-15-25-48)52-36-34-51(35-37-52)55(46-20-10-3-11-21-46)47-22-12-4-13-23-47;1-4-13-38(14-5-1)40-23-27-46(28-24-40)54(47-29-25-41(26-30-47)39-15-6-2-7-16-39)48-31-33-50-43(36-48)35-44-37-49(32-34-51(44)50)55(45-19-8-3-9-20-45)53-22-12-18-42-17-10-11-21-52(42)53/h1-38,41-42H,39-40H2;3-44H,1-2H3;1-41H;1-34,36-37H,35H2 |
| InChIKey | JPLFIHVTHDQPJE-UHFFFAOYSA-N |
| XLogP | 64.46 |
| TPSA | 29.16 Ų |
| H-Bond Donors | |
| H-Bond Acceptors | 9 |
| Rotatable Bonds | 39 |
| Heavy Atoms | 240 |
| Complexity | — |
2 violations
| Rule | Value |
|---|---|
| MW ≤ 500 | 3072.97 |
| LogP ≤ 5 | 64.46 |
| H-Bond Donors ≤ 5 | 0 |
| H-Bond Acceptors ≤ 10 | 9 |