C312H208N12O3 — CID 161084145
N,N-bis(4-naphthalen-1-ylphenyl)-12-phenylindolo[1,2-b]isoquinolin-9-amine;N-dibenzofuran-3-yl-N-[3-[3-(12-phenylindolo[1,2-b]isoquinolin-8-yl)phenyl]phenyl]dibenzofuran-3-amine;N,N-diphenyl-4-[4-(12-phenylindolo[1,2-b]isoquinolin-8-yl)phenyl]aniline;N-(4-naphthalen-1-ylphenyl)-12-phenyl-N-[4-(4-phenylphenyl)phenyl]indolo[1,2-b]isoquinolin-9-amine;12-phenyl-N,N-bis(4-phenylphenyl)indolo[1,2-b]isoquinolin-9-amine;N-[3-(12-phenylindolo[1,2-b]isoquinolin-8-yl)phenyl]-N-(3-phenylphenyl)dibenzofuran-3-amine (PubChem CID 161084145) has the molecular formula C312H208N12O3 and a molecular weight of 4173.18 g/mol. Its IUPAC name is N,N-bis(4-naphthalen-1-ylphenyl)-12-phenylindolo[1,2-b]isoquinolin-9-amine;N-dibenzofuran-3-yl-N-[3-[3-(12-phenylindolo[1,2-b]isoquinolin-8-yl)phenyl]phenyl]dibenzofuran-3-amine;N,N-diphenyl-4-[4-(12-phenylindolo[1,2-b]isoquinolin-8-yl)phenyl]aniline;N-(4-naphthalen-1-ylphenyl)-12-phenyl-N-[4-(4-phenylphenyl)phenyl]indolo[1,2-b]isoquinolin-9-amine;12-phenyl-N,N-bis(4-phenylphenyl)indolo[1,2-b]isoquinolin-9-amine;N-[3-(12-phenylindolo[1,2-b]isoquinolin-8-yl)phenyl]-N-(3-phenylphenyl)dibenzofuran-3-amine.
| Compound Name | N,N-bis(4-naphthalen-1-ylphenyl)-12-phenylindolo[1,2-b]isoquinolin-9-amine;N-dibenzofuran-3-yl-N-[3-[3-(12-phenylindolo[1,2-b]isoquinolin-8-yl)phenyl]phenyl]dibenzofuran-3-amine;N,N-diphenyl-4-[4-(12-phenylindolo[1,2-b]isoquinolin-8-yl)phenyl]aniline;N-(4-naphthalen-1-ylphenyl)-12-phenyl-N-[4-(4-phenylphenyl)phenyl]indolo[1,2-b]isoquinolin-9-amine;12-phenyl-N,N-bis(4-phenylphenyl)indolo[1,2-b]isoquinolin-9-amine;N-[3-(12-phenylindolo[1,2-b]isoquinolin-8-yl)phenyl]-N-(3-phenylphenyl)dibenzofuran-3-amine |
|---|---|
| PubChem CID | 161084145 |
| Molecular Formula | C312H208N12O3 |
| Molecular Weight | 4173.18 g/mol |
| Exact Mass | 4169.65 |
| IUPAC Name | N,N-bis(4-naphthalen-1-ylphenyl)-12-phenylindolo[1,2-b]isoquinolin-9-amine;N-dibenzofuran-3-yl-N-[3-[3-(12-phenylindolo[1,2-b]isoquinolin-8-yl)phenyl]phenyl]dibenzofuran-3-amine;N,N-diphenyl-4-[4-(12-phenylindolo[1,2-b]isoquinolin-8-yl)phenyl]aniline;N-(4-naphthalen-1-ylphenyl)-12-phenyl-N-[4-(4-phenylphenyl)phenyl]indolo[1,2-b]isoquinolin-9-amine;12-phenyl-N,N-bis(4-phenylphenyl)indolo[1,2-b]isoquinolin-9-amine;N-[3-(12-phenylindolo[1,2-b]isoquinolin-8-yl)phenyl]-N-(3-phenylphenyl)dibenzofuran-3-amine |
| SMILES | c1ccc(-c2c3ccccc3n3cc4cc(-c5ccc(-c6ccc(N(c7ccccc7)c7ccccc7)cc6)cc5)ccc4cc23)cc1.c1ccc(-c2c3ccccc3n3cc4cc(-c5cccc(-c6cccc(N(c7ccc8c(c7)oc7ccccc78)c7ccc8c(c7)oc7ccccc78)c6)c5)ccc4cc23)cc1.c1ccc(-c2c3ccccc3n3cc4ccc(N(c5ccc(-c6cccc7ccccc67)cc5)c5ccc(-c6cccc7ccccc67)cc5)cc4cc23)cc1.c1ccc(-c2ccc(-c3ccc(N(c4ccc(-c5cccc6ccccc56)cc4)c4ccc5cn6c(cc5c4)c(-c4ccccc4)c4ccccc46)cc3)cc2)cc1.c1ccc(-c2ccc(N(c3ccc(-c4ccccc4)cc3)c3ccc4cn5c(cc4c3)c(-c3ccccc3)c3ccccc35)cc2)cc1.c1ccc(-c2cccc(N(c3cccc(-c4ccc5cc6c(-c7ccccc7)c7ccccc7n6cc5c4)c3)c3ccc4c(c3)oc3ccccc34)c2)cc1 |
| InChI | InChI=1S/C58H36N2O2.C56H38N2.C54H36N2.C52H34N2O.2C46H32N2/c1-2-12-37(13-3-1)58-51-20-4-7-21-52(51)59-36-43-31-41(24-25-42(43)33-53(58)59)39-15-10-14-38(30-39)40-16-11-17-44(32-40)60(45-26-28-49-47-18-5-8-22-54(47)61-56(49)34-45)46-27-29-50-48-19-6-9-23-55(48)62-57(50)35-46;1-3-12-39(13-4-1)40-22-24-41(25-23-40)42-26-31-48(32-27-42)58(49-33-28-44(29-34-49)52-20-11-17-43-14-7-8-18-51(43)52)50-35-30-46-38-57-54-21-10-9-19-53(54)56(45-15-5-2-6-16-45)55(57)37-47(46)36-50;1-2-14-41(15-3-1)54-51-20-8-9-23-52(51)55-36-42-28-33-46(34-43(42)35-53(54)55)56(44-29-24-39(25-30-44)49-21-10-16-37-12-4-6-18-47(37)49)45-31-26-40(27-32-45)50-22-11-17-38-13-5-7-19-48(38)50;1-3-13-35(14-4-1)37-17-11-19-42(30-37)54(44-27-28-46-45-21-8-10-24-50(45)55-51(46)33-44)43-20-12-18-38(31-43)39-25-26-40-32-49-52(36-15-5-2-6-16-36)47-22-7-9-23-48(47)53(49)34-41(40)29-39;1-4-12-33(13-5-1)35-20-25-40(26-21-35)48(41-27-22-36(23-28-41)34-14-6-2-7-15-34)42-29-24-38-32-47-44-19-11-10-18-43(44)46(37-16-8-3-9-17-37)45(47)31-39(38)30-42;1-4-12-36(13-5-1)46-43-18-10-11-19-44(43)47-32-39-30-37(24-25-38(39)31-45(46)47)35-22-20-33(21-23-35)34-26-28-42(29-27-34)48(40-14-6-2-7-15-40)41-16-8-3-9-17-41/h1-36H;1-38H;1-36H;1-34H;2*1-32H |
| InChIKey | UGHBDUZTTCSSIC-UHFFFAOYSA-N |
| XLogP | 87.12 |
| TPSA | 85.32 Ų |
| H-Bond Donors | |
| H-Bond Acceptors | 15 |
| Rotatable Bonds | 37 |
| Heavy Atoms | 327 |
| Complexity | — |
3 violations
| Rule | Value |
|---|---|
| MW ≤ 500 | 4173.18 |
| LogP ≤ 5 | 87.12 |
| H-Bond Donors ≤ 5 | 0 |
| H-Bond Acceptors ≤ 10 | 15 |