C281H195FN12 — CID 161042212
N-(9,9-dimethylfluoren-2-yl)-N-[4-[1-(4-fluorophenyl)-2,3-diphenylbenzo[g]indol-5-yl]phenyl]-9-phenylcarbazol-3-amine;N-(9,9-dimethylfluoren-2-yl)-N-[4-(1-naphthalen-1-yl-2,3-diphenylbenzo[g]indol-5-yl)phenyl]-9-phenylcarbazol-3-amine;N-(9,9-dimethylfluoren-2-yl)-9-phenyl-N-[4-(1,2,3-triphenylbenzo[g]indol-5-yl)phenyl]carbazol-3-amine;N-[4-[2,3-diphenyl-1-(4-phenylphenyl)benzo[g]indol-5-yl]phenyl]-N-naphthalen-1-yl-9-phenylcarbazol-3-amine (PubChem CID 161042212) has the molecular formula C281H195FN12 and a molecular weight of 3758.73 g/mol. Its IUPAC name is N-(9,9-dimethylfluoren-2-yl)-N-[4-[1-(4-fluorophenyl)-2,3-diphenylbenzo[g]indol-5-yl]phenyl]-9-phenylcarbazol-3-amine;N-(9,9-dimethylfluoren-2-yl)-N-[4-(1-naphthalen-1-yl-2,3-diphenylbenzo[g]indol-5-yl)phenyl]-9-phenylcarbazol-3-amine;N-(9,9-dimethylfluoren-2-yl)-9-phenyl-N-[4-(1,2,3-triphenylbenzo[g]indol-5-yl)phenyl]carbazol-3-amine;N-[4-[2,3-diphenyl-1-(4-phenylphenyl)benzo[g]indol-5-yl]phenyl]-N-naphthalen-1-yl-9-phenylcarbazol-3-amine.
| Compound Name | N-(9,9-dimethylfluoren-2-yl)-N-[4-[1-(4-fluorophenyl)-2,3-diphenylbenzo[g]indol-5-yl]phenyl]-9-phenylcarbazol-3-amine;N-(9,9-dimethylfluoren-2-yl)-N-[4-(1-naphthalen-1-yl-2,3-diphenylbenzo[g]indol-5-yl)phenyl]-9-phenylcarbazol-3-amine;N-(9,9-dimethylfluoren-2-yl)-9-phenyl-N-[4-(1,2,3-triphenylbenzo[g]indol-5-yl)phenyl]carbazol-3-amine;N-[4-[2,3-diphenyl-1-(4-phenylphenyl)benzo[g]indol-5-yl]phenyl]-N-naphthalen-1-yl-9-phenylcarbazol-3-amine |
|---|---|
| PubChem CID | 161042212 |
| Molecular Formula | C281H195FN12 |
| Molecular Weight | 3758.73 g/mol |
| Exact Mass | 3755.56 |
| IUPAC Name | N-(9,9-dimethylfluoren-2-yl)-N-[4-[1-(4-fluorophenyl)-2,3-diphenylbenzo[g]indol-5-yl]phenyl]-9-phenylcarbazol-3-amine;N-(9,9-dimethylfluoren-2-yl)-N-[4-(1-naphthalen-1-yl-2,3-diphenylbenzo[g]indol-5-yl)phenyl]-9-phenylcarbazol-3-amine;N-(9,9-dimethylfluoren-2-yl)-9-phenyl-N-[4-(1,2,3-triphenylbenzo[g]indol-5-yl)phenyl]carbazol-3-amine;N-[4-[2,3-diphenyl-1-(4-phenylphenyl)benzo[g]indol-5-yl]phenyl]-N-naphthalen-1-yl-9-phenylcarbazol-3-amine |
| SMILES | CC1(C)c2ccccc2-c2ccc(N(c3ccc(-c4cc5c(-c6ccccc6)c(-c6ccccc6)n(-c6ccc(F)cc6)c5c5ccccc45)cc3)c3ccc4c(c3)c3ccccc3n4-c3ccccc3)cc21.CC1(C)c2ccccc2-c2ccc(N(c3ccc(-c4cc5c(-c6ccccc6)c(-c6ccccc6)n(-c6cccc7ccccc67)c5c5ccccc45)cc3)c3ccc4c(c3)c3ccccc3n4-c3ccccc3)cc21.CC1(C)c2ccccc2-c2ccc(N(c3ccc(-c4cc5c(-c6ccccc6)c(-c6ccccc6)n(-c6ccccc6)c5c5ccccc45)cc3)c3ccc4c(c3)c3ccccc3n4-c3ccccc3)cc21.c1ccc(-c2ccc(-n3c(-c4ccccc4)c(-c4ccccc4)c4cc(-c5ccc(N(c6ccc7c(c6)c6ccccc6n7-c6ccccc6)c6cccc7ccccc67)cc5)c5ccccc5c43)cc2)cc1 |
| InChI | InChI=1S/C73H51N3.C70H47N3.C69H48FN3.C69H49N3/c1-73(2)65-34-18-16-31-58(65)59-43-41-55(46-66(59)73)74(54-42-44-69-63(45-54)60-32-17-19-35-68(60)75(69)52-27-10-5-11-28-52)53-39-37-49(38-40-53)62-47-64-70(50-22-6-3-7-23-50)71(51-24-8-4-9-25-51)76(72(64)61-33-15-14-30-57(61)62)67-36-20-26-48-21-12-13-29-56(48)67;1-5-20-48(21-6-1)49-36-40-56(41-37-49)73-69(53-25-9-3-10-26-53)68(52-23-7-2-8-24-52)64-47-62(59-31-15-16-33-61(59)70(64)73)51-38-42-55(43-39-51)71(65-35-19-27-50-22-13-14-30-58(50)65)57-44-45-67-63(46-57)60-32-17-18-34-66(60)72(67)54-28-11-4-12-29-54;1-69(2)62-28-16-14-25-55(62)56-40-38-53(43-63(56)69)71(52-39-41-65-60(42-52)57-26-15-17-29-64(57)72(65)49-22-10-5-11-23-49)50-34-30-45(31-35-50)59-44-61-66(46-18-6-3-7-19-46)67(47-20-8-4-9-21-47)73(51-36-32-48(70)33-37-51)68(61)58-27-13-12-24-54(58)59;1-69(2)62-33-19-17-30-55(62)56-41-39-53(44-63(56)69)70(52-40-42-65-60(43-52)57-31-18-20-34-64(57)71(65)49-25-11-5-12-26-49)51-37-35-46(36-38-51)59-45-61-66(47-21-7-3-8-22-47)67(48-23-9-4-10-24-48)72(50-27-13-6-14-28-50)68(61)58-32-16-15-29-54(58)59/h3-47H,1-2H3;1-47H;3-44H,1-2H3;3-45H,1-2H3 |
| InChIKey | UBAKHDBLQBQEJO-UHFFFAOYSA-N |
| XLogP | 76.44 |
| TPSA | 52.40 Ų |
| H-Bond Donors | |
| H-Bond Acceptors | 12 |
| Rotatable Bonds | 33 |
| Heavy Atoms | 294 |
| Complexity | — |
3 violations
| Rule | Value |
|---|---|
| MW ≤ 500 | 3758.73 |
| LogP ≤ 5 | 76.44 |
| H-Bond Donors ≤ 5 | 0 |
| H-Bond Acceptors ≤ 10 | 12 |