C464H310N30 — CID 157252892
N-(4-carbazol-9-ylphenyl)-4-[3-[4-(N-(4-carbazol-9-ylphenyl)anilino)naphthalen-1-yl]quinoxalin-2-yl]-N-phenylnaphthalen-1-amine;N-(4-carbazol-9-ylphenyl)-4-[3-[4-(N-(4-carbazol-9-ylphenyl)anilino)phenyl]-5,8-bis(9,9-dimethylfluoren-2-yl)quinoxalin-2-yl]-N-phenylaniline;N-(4-carbazol-9-ylphenyl)-4-[3-[4-(N-(4-carbazol-9-ylphenyl)anilino)phenyl]-5,8-bis(4-phenylphenyl)quinoxalin-2-yl]-N-phenylaniline;N-(4-carbazol-9-ylphenyl)-4-[3-[4-(N-(4-carbazol-9-ylphenyl)anilino)phenyl]-5,8-bis(9,9'-spirobi[fluorene]-2-yl)quinoxalin-2-yl]-N-phenylaniline;N-(4-carbazol-9-ylphenyl)-4-[3-[4-(N-(4-carbazol-9-ylphenyl)anilino)phenyl]-5,8-diphenylquinoxalin-2-yl]-N-phenylaniline (PubChem CID 157252892) has the molecular formula C464H310N30 and a molecular weight of 6305.79 g/mol. Its IUPAC name is N-(4-carbazol-9-ylphenyl)-4-[3-[4-(N-(4-carbazol-9-ylphenyl)anilino)naphthalen-1-yl]quinoxalin-2-yl]-N-phenylnaphthalen-1-amine;N-(4-carbazol-9-ylphenyl)-4-[3-[4-(N-(4-carbazol-9-ylphenyl)anilino)phenyl]-5,8-bis(9,9-dimethylfluoren-2-yl)quinoxalin-2-yl]-N-phenylaniline;N-(4-carbazol-9-ylphenyl)-4-[3-[4-(N-(4-carbazol-9-ylphenyl)anilino)phenyl]-5,8-bis(4-phenylphenyl)quinoxalin-2-yl]-N-phenylaniline;N-(4-carbazol-9-ylphenyl)-4-[3-[4-(N-(4-carbazol-9-ylphenyl)anilino)phenyl]-5,8-bis(9,9'-spirobi[fluorene]-2-yl)quinoxalin-2-yl]-N-phenylaniline;N-(4-carbazol-9-ylphenyl)-4-[3-[4-(N-(4-carbazol-9-ylphenyl)anilino)phenyl]-5,8-diphenylquinoxalin-2-yl]-N-phenylaniline.
| Compound Name | N-(4-carbazol-9-ylphenyl)-4-[3-[4-(N-(4-carbazol-9-ylphenyl)anilino)naphthalen-1-yl]quinoxalin-2-yl]-N-phenylnaphthalen-1-amine;N-(4-carbazol-9-ylphenyl)-4-[3-[4-(N-(4-carbazol-9-ylphenyl)anilino)phenyl]-5,8-bis(9,9-dimethylfluoren-2-yl)quinoxalin-2-yl]-N-phenylaniline;N-(4-carbazol-9-ylphenyl)-4-[3-[4-(N-(4-carbazol-9-ylphenyl)anilino)phenyl]-5,8-bis(4-phenylphenyl)quinoxalin-2-yl]-N-phenylaniline;N-(4-carbazol-9-ylphenyl)-4-[3-[4-(N-(4-carbazol-9-ylphenyl)anilino)phenyl]-5,8-bis(9,9'-spirobi[fluorene]-2-yl)quinoxalin-2-yl]-N-phenylaniline;N-(4-carbazol-9-ylphenyl)-4-[3-[4-(N-(4-carbazol-9-ylphenyl)anilino)phenyl]-5,8-diphenylquinoxalin-2-yl]-N-phenylaniline |
|---|---|
| PubChem CID | 157252892 |
| Molecular Formula | C464H310N30 |
| Molecular Weight | 6305.79 g/mol |
| Exact Mass | 6300.52 |
| IUPAC Name | N-(4-carbazol-9-ylphenyl)-4-[3-[4-(N-(4-carbazol-9-ylphenyl)anilino)naphthalen-1-yl]quinoxalin-2-yl]-N-phenylnaphthalen-1-amine;N-(4-carbazol-9-ylphenyl)-4-[3-[4-(N-(4-carbazol-9-ylphenyl)anilino)phenyl]-5,8-bis(9,9-dimethylfluoren-2-yl)quinoxalin-2-yl]-N-phenylaniline;N-(4-carbazol-9-ylphenyl)-4-[3-[4-(N-(4-carbazol-9-ylphenyl)anilino)phenyl]-5,8-bis(4-phenylphenyl)quinoxalin-2-yl]-N-phenylaniline;N-(4-carbazol-9-ylphenyl)-4-[3-[4-(N-(4-carbazol-9-ylphenyl)anilino)phenyl]-5,8-bis(9,9'-spirobi[fluorene]-2-yl)quinoxalin-2-yl]-N-phenylaniline;N-(4-carbazol-9-ylphenyl)-4-[3-[4-(N-(4-carbazol-9-ylphenyl)anilino)phenyl]-5,8-diphenylquinoxalin-2-yl]-N-phenylaniline |
| SMILES | CC1(C)c2ccccc2-c2ccc(-c3ccc(-c4ccc5c(c4)C(C)(C)c4ccccc4-5)c4nc(-c5ccc(N(c6ccccc6)c6ccc(-n7c8ccccc8c8ccccc87)cc6)cc5)c(-c5ccc(N(c6ccccc6)c6ccc(-n7c8ccccc8c8ccccc87)cc6)cc5)nc34)cc21.c1ccc(-c2ccc(-c3ccc(-c4ccc(-c5ccccc5)cc4)c4nc(-c5ccc(N(c6ccccc6)c6ccc(-n7c8ccccc8c8ccccc87)cc6)cc5)c(-c5ccc(N(c6ccccc6)c6ccc(-n7c8ccccc8c8ccccc87)cc6)cc5)nc34)cc2)cc1.c1ccc(-c2ccc(-c3ccccc3)c3nc(-c4ccc(N(c5ccccc5)c5ccc(-n6c7ccccc7c7ccccc76)cc5)cc4)c(-c4ccc(N(c5ccccc5)c5ccc(-n6c7ccccc7c7ccccc76)cc5)cc4)nc23)cc1.c1ccc(N(c2ccc(-c3nc4c(-c5ccc6c(c5)C5(c7ccccc7-c7ccccc75)c5ccccc5-6)ccc(-c5ccc6c(c5)C5(c7ccccc7-c7ccccc75)c5ccccc5-6)c4nc3-c3ccc(N(c4ccccc4)c4ccc(-n5c6ccccc6c6ccccc65)cc4)cc3)cc2)c2ccc(-n3c4ccccc4c4ccccc43)cc2)cc1.c1ccc(N(c2ccc(-n3c4ccccc4c4ccccc43)cc2)c2ccc(-c3nc4ccccc4nc3-c3ccc(N(c4ccccc4)c4ccc(-n5c6ccccc6c6ccccc65)cc4)c4ccccc34)c3ccccc23)cc1 |
| InChI | InChI=1S/C118H74N6.C98H70N6.C92H62N6.C80H54N6.C76H50N6/c1-3-27-79(28-4-1)121(83-61-65-85(66-62-83)123-109-47-23-13-37-97(109)98-38-14-24-48-110(98)123)81-57-51-75(52-58-81)113-114(76-53-59-82(60-54-76)122(80-29-5-2-6-30-80)84-63-67-86(68-64-84)124-111-49-25-15-39-99(111)100-40-16-26-50-112(100)124)120-116-88(78-56-70-96-94-36-12-22-46-106(94)118(108(96)74-78)103-43-19-9-33-91(103)92-34-10-20-44-104(92)118)72-71-87(115(116)119-113)77-55-69-95-93-35-11-21-45-105(93)117(107(95)73-77)101-41-17-7-31-89(101)90-32-8-18-42-102(90)117;1-97(2)85-33-17-11-27-77(85)79-57-43-65(61-87(79)97)75-59-60-76(66-44-58-80-78-28-12-18-34-86(78)98(3,4)88(80)62-66)96-95(75)99-93(63-39-45-69(46-40-63)101(67-23-7-5-8-24-67)71-49-53-73(54-50-71)103-89-35-19-13-29-81(89)82-30-14-20-36-90(82)103)94(100-96)64-41-47-70(48-42-64)102(68-25-9-6-10-26-68)72-51-55-74(56-52-72)104-91-37-21-15-31-83(91)84-32-16-22-38-92(84)104;1-5-21-63(22-6-1)65-37-41-67(42-38-65)79-61-62-80(68-43-39-66(40-44-68)64-23-7-2-8-24-64)92-91(79)93-89(69-45-49-73(50-46-69)95(71-25-9-3-10-26-71)75-53-57-77(58-54-75)97-85-33-17-13-29-81(85)82-30-14-18-34-86(82)97)90(94-92)70-47-51-74(52-48-70)96(72-27-11-4-12-28-72)76-55-59-78(60-56-76)98-87-35-19-15-31-83(87)84-32-16-20-36-88(84)98;1-5-21-55(22-6-1)67-53-54-68(56-23-7-2-8-24-56)80-79(67)81-77(57-37-41-61(42-38-57)83(59-25-9-3-10-26-59)63-45-49-65(50-46-63)85-73-33-17-13-29-69(73)70-30-14-18-34-74(70)85)78(82-80)58-39-43-62(44-40-58)84(60-27-11-4-12-28-60)64-47-51-66(52-48-64)86-75-35-19-15-31-71(75)72-32-16-20-36-76(72)86;1-3-21-51(22-4-1)79(53-39-43-55(44-40-53)81-69-35-17-11-29-61(69)62-30-12-18-36-70(62)81)73-49-47-65(57-25-7-9-27-59(57)73)75-76(78-68-34-16-15-33-67(68)77-75)66-48-50-74(60-28-10-8-26-58(60)66)80(52-23-5-2-6-24-52)54-41-45-56(46-42-54)82-71-37-19-13-31-63(71)64-32-14-20-38-72(64)82/h1-74H;5-62H,1-4H3;1-62H;1-54H;1-50H |
| InChIKey | AWNSHYVAOQFBRO-UHFFFAOYSA-N |
| XLogP | 122.76 |
| TPSA | 210.60 Ų |
| H-Bond Donors | |
| H-Bond Acceptors | 30 |
| Rotatable Bonds | 60 |
| Heavy Atoms | 494 |
| Complexity | — |
3 violations
| Rule | Value |
|---|---|
| MW ≤ 500 | 6305.79 |
| LogP ≤ 5 | 122.76 |
| H-Bond Donors ≤ 5 | 0 |
| H-Bond Acceptors ≤ 10 | 30 |