C155H105N3O4 — CID 161386927
N,N-bis(4-dibenzofuran-4-ylphenyl)-4-phenylaniline;4-(3-dibenzofuran-4-ylphenyl)-N,N-bis(4-naphthalen-1-ylphenyl)aniline;N-(4-dibenzofuran-4-ylphenyl)-9,9-dimethyl-N-[4-(4-phenylphenyl)phenyl]fluoren-2-amine (PubChem CID 161386927) has the molecular formula C155H105N3O4 and a molecular weight of 2073.56 g/mol. Its IUPAC name is N,N-bis(4-dibenzofuran-4-ylphenyl)-4-phenylaniline;4-(3-dibenzofuran-4-ylphenyl)-N,N-bis(4-naphthalen-1-ylphenyl)aniline;N-(4-dibenzofuran-4-ylphenyl)-9,9-dimethyl-N-[4-(4-phenylphenyl)phenyl]fluoren-2-amine.
| Compound Name | N,N-bis(4-dibenzofuran-4-ylphenyl)-4-phenylaniline;4-(3-dibenzofuran-4-ylphenyl)-N,N-bis(4-naphthalen-1-ylphenyl)aniline;N-(4-dibenzofuran-4-ylphenyl)-9,9-dimethyl-N-[4-(4-phenylphenyl)phenyl]fluoren-2-amine |
|---|---|
| PubChem CID | 161386927 |
| Molecular Formula | C155H105N3O4 |
| Molecular Weight | 2073.56 g/mol |
| Exact Mass | 2071.81 |
| IUPAC Name | N,N-bis(4-dibenzofuran-4-ylphenyl)-4-phenylaniline;4-(3-dibenzofuran-4-ylphenyl)-N,N-bis(4-naphthalen-1-ylphenyl)aniline;N-(4-dibenzofuran-4-ylphenyl)-9,9-dimethyl-N-[4-(4-phenylphenyl)phenyl]fluoren-2-amine |
| SMILES | CC1(C)c2ccccc2-c2ccc(N(c3ccc(-c4ccc(-c5ccccc5)cc4)cc3)c3ccc(-c4cccc5c4oc4ccccc45)cc3)cc21.c1cc(-c2ccc(N(c3ccc(-c4cccc5ccccc45)cc3)c3ccc(-c4cccc5ccccc45)cc3)cc2)cc(-c2cccc3c2oc2ccccc23)c1.c1ccc(-c2ccc(N(c3ccc(-c4cccc5c4oc4ccccc45)cc3)c3ccc(-c4cccc5c4oc4ccccc45)cc3)cc2)cc1 |
| InChI | InChI=1S/C56H37NO.C51H37NO.C48H31NO2/c1-3-17-48-39(11-1)13-8-20-50(48)41-27-33-46(34-28-41)57(47-35-29-42(30-36-47)51-21-9-14-40-12-2-4-18-49(40)51)45-31-25-38(26-32-45)43-15-7-16-44(37-43)52-22-10-23-54-53-19-5-6-24-55(53)58-56(52)54;1-51(2)47-17-8-6-13-43(47)44-32-31-41(33-48(44)51)52(39-27-23-37(24-28-39)36-21-19-35(20-22-36)34-11-4-3-5-12-34)40-29-25-38(26-30-40)42-15-10-16-46-45-14-7-9-18-49(45)53-50(42)46;1-2-10-32(11-3-1)33-20-26-36(27-21-33)49(37-28-22-34(23-29-37)39-14-8-16-43-41-12-4-6-18-45(41)50-47(39)43)38-30-24-35(25-31-38)40-15-9-17-44-42-13-5-7-19-46(42)51-48(40)44/h1-37H;3-33H,1-2H3;1-31H |
| InChIKey | VSLYSRIGKQYFGW-UHFFFAOYSA-N |
| XLogP | 44.35 |
| TPSA | 62.28 Ų |
| H-Bond Donors | |
| H-Bond Acceptors | 7 |
| Rotatable Bonds | 19 |
| Heavy Atoms | 162 |
| Complexity | — |
2 violations
| Rule | Value |
|---|---|
| MW ≤ 500 | 2073.56 |
| LogP ≤ 5 | 44.35 |
| H-Bond Donors ≤ 5 | 0 |
| H-Bond Acceptors ≤ 10 | 7 |