C238H172N8 — CID 161371877
N,4-diphenyl-N-[4-[4-(N-[4-(4-phenylphenyl)phenyl]anilino)phenyl]phenyl]aniline;2-N-naphthalen-1-yl-2-N-phenyl-7-N,7-N-bis(4-phenylphenyl)-9H-fluorene-2,7-diamine;2-N-naphthalen-1-yl-2-N,9,9-triphenyl-7-N,7-N-bis(4-phenylphenyl)fluorene-2,7-diamine;4-phenyl-N-(4-phenylphenyl)-N-[4-[4-(4-phenyl-N-[4-(4-phenylphenyl)phenyl]anilino)phenyl]phenyl]aniline (PubChem CID 161371877) has the molecular formula C238H172N8 and a molecular weight of 3144.05 g/mol. Its IUPAC name is N,4-diphenyl-N-[4-[4-(N-[4-(4-phenylphenyl)phenyl]anilino)phenyl]phenyl]aniline;2-N-naphthalen-1-yl-2-N-phenyl-7-N,7-N-bis(4-phenylphenyl)-9H-fluorene-2,7-diamine;2-N-naphthalen-1-yl-2-N,9,9-triphenyl-7-N,7-N-bis(4-phenylphenyl)fluorene-2,7-diamine;4-phenyl-N-(4-phenylphenyl)-N-[4-[4-(4-phenyl-N-[4-(4-phenylphenyl)phenyl]anilino)phenyl]phenyl]aniline.
| Compound Name | N,4-diphenyl-N-[4-[4-(N-[4-(4-phenylphenyl)phenyl]anilino)phenyl]phenyl]aniline;2-N-naphthalen-1-yl-2-N-phenyl-7-N,7-N-bis(4-phenylphenyl)-9H-fluorene-2,7-diamine;2-N-naphthalen-1-yl-2-N,9,9-triphenyl-7-N,7-N-bis(4-phenylphenyl)fluorene-2,7-diamine;4-phenyl-N-(4-phenylphenyl)-N-[4-[4-(4-phenyl-N-[4-(4-phenylphenyl)phenyl]anilino)phenyl]phenyl]aniline |
|---|---|
| PubChem CID | 161371877 |
| Molecular Formula | C238H172N8 |
| Molecular Weight | 3144.05 g/mol |
| Exact Mass | 3141.37 |
| IUPAC Name | N,4-diphenyl-N-[4-[4-(N-[4-(4-phenylphenyl)phenyl]anilino)phenyl]phenyl]aniline;2-N-naphthalen-1-yl-2-N-phenyl-7-N,7-N-bis(4-phenylphenyl)-9H-fluorene-2,7-diamine;2-N-naphthalen-1-yl-2-N,9,9-triphenyl-7-N,7-N-bis(4-phenylphenyl)fluorene-2,7-diamine;4-phenyl-N-(4-phenylphenyl)-N-[4-[4-(4-phenyl-N-[4-(4-phenylphenyl)phenyl]anilino)phenyl]phenyl]aniline |
| SMILES | c1ccc(-c2ccc(-c3ccc(N(c4ccc(-c5ccccc5)cc4)c4ccc(-c5ccc(N(c6ccc(-c7ccccc7)cc6)c6ccc(-c7ccccc7)cc6)cc5)cc4)cc3)cc2)cc1.c1ccc(-c2ccc(-c3ccc(N(c4ccccc4)c4ccc(-c5ccc(N(c6ccccc6)c6ccc(-c7ccccc7)cc6)cc5)cc4)cc3)cc2)cc1.c1ccc(-c2ccc(N(c3ccc(-c4ccccc4)cc3)c3ccc4c(c3)C(c3ccccc3)(c3ccccc3)c3cc(N(c5ccccc5)c5cccc6ccccc56)ccc3-4)cc2)cc1.c1ccc(-c2ccc(N(c3ccc(-c4ccccc4)cc3)c3ccc4c(c3)Cc3cc(N(c5ccccc5)c5cccc6ccccc56)ccc3-4)cc2)cc1 |
| InChI | InChI=1S/C66H48N2.C65H46N2.C54H40N2.C53H38N2/c1-5-13-49(14-6-1)53-21-23-54(24-22-53)58-31-43-64(44-32-58)68(63-41-29-57(30-42-63)52-19-11-4-12-20-52)66-47-35-60(36-48-66)59-33-45-65(46-34-59)67(61-37-25-55(26-38-61)50-15-7-2-8-16-50)62-39-27-56(28-40-62)51-17-9-3-10-18-51;1-6-19-47(20-7-1)49-33-37-55(38-34-49)66(56-39-35-50(36-40-56)48-21-8-2-9-22-48)57-41-43-60-61-44-42-58(67(54-29-14-5-15-30-54)64-32-18-24-51-23-16-17-31-59(51)64)46-63(61)65(62(60)45-57,52-25-10-3-11-26-52)53-27-12-4-13-28-53;1-5-13-41(14-6-1)43-21-23-44(24-22-43)46-27-35-52(36-28-46)56(50-19-11-4-12-20-50)54-39-31-48(32-40-54)47-29-37-53(38-30-47)55(49-17-9-3-10-18-49)51-33-25-45(26-34-51)42-15-7-2-8-16-42;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/h1-48H;1-46H;1-40H;1-34,36-37H,35H2 |
| InChIKey | VQOJLAFVABPLEZ-UHFFFAOYSA-N |
| XLogP | 66.08 |
| TPSA | 25.92 Ų |
| H-Bond Donors | |
| H-Bond Acceptors | 8 |
| Rotatable Bonds | 40 |
| Heavy Atoms | 246 |
| Complexity | — |
2 violations
| Rule | Value |
|---|---|
| MW ≤ 500 | 3144.05 |
| LogP ≤ 5 | 66.08 |
| H-Bond Donors ≤ 5 | 0 |
| H-Bond Acceptors ≤ 10 | 8 |