C188H136N6 — CID 161349571
9,9-dimethyl-N-[4-(9-phenylcarbazol-3-yl)phenyl]-N-(4-tritylphenyl)fluoren-2-amine;3-naphthalen-2-yl-N-[4-(9-phenylcarbazol-3-yl)phenyl]-N-(4-tritylphenyl)aniline;N-[4-(9-phenylcarbazol-3-yl)phenyl]-N-(4-tritylphenyl)naphthalen-2-amine (PubChem CID 161349571) has the molecular formula C188H136N6 and a molecular weight of 2479.20 g/mol. Its IUPAC name is 9,9-dimethyl-N-[4-(9-phenylcarbazol-3-yl)phenyl]-N-(4-tritylphenyl)fluoren-2-amine;3-naphthalen-2-yl-N-[4-(9-phenylcarbazol-3-yl)phenyl]-N-(4-tritylphenyl)aniline;N-[4-(9-phenylcarbazol-3-yl)phenyl]-N-(4-tritylphenyl)naphthalen-2-amine.
| Compound Name | 9,9-dimethyl-N-[4-(9-phenylcarbazol-3-yl)phenyl]-N-(4-tritylphenyl)fluoren-2-amine;3-naphthalen-2-yl-N-[4-(9-phenylcarbazol-3-yl)phenyl]-N-(4-tritylphenyl)aniline;N-[4-(9-phenylcarbazol-3-yl)phenyl]-N-(4-tritylphenyl)naphthalen-2-amine |
|---|---|
| PubChem CID | 161349571 |
| Molecular Formula | C188H136N6 |
| Molecular Weight | 2479.20 g/mol |
| Exact Mass | 2477.08 |
| IUPAC Name | 9,9-dimethyl-N-[4-(9-phenylcarbazol-3-yl)phenyl]-N-(4-tritylphenyl)fluoren-2-amine;3-naphthalen-2-yl-N-[4-(9-phenylcarbazol-3-yl)phenyl]-N-(4-tritylphenyl)aniline;N-[4-(9-phenylcarbazol-3-yl)phenyl]-N-(4-tritylphenyl)naphthalen-2-amine |
| SMILES | CC1(C)c2ccccc2-c2ccc(N(c3ccc(-c4ccc5c(c4)c4ccccc4n5-c4ccccc4)cc3)c3ccc(C(c4ccccc4)(c4ccccc4)c4ccccc4)cc3)cc21.c1ccc(-n2c3ccccc3c3cc(-c4ccc(N(c5ccc(C(c6ccccc6)(c6ccccc6)c6ccccc6)cc5)c5ccc6ccccc6c5)cc4)ccc32)cc1.c1ccc(-n2c3ccccc3c3cc(-c4ccc(N(c5ccc(C(c6ccccc6)(c6ccccc6)c6ccccc6)cc5)c5cccc(-c6ccc7ccccc7c6)c5)cc4)ccc32)cc1 |
| InChI | InChI=1S/C65H46N2.C64H48N2.C59H42N2/c1-5-21-53(22-6-1)65(54-23-7-2-8-24-54,55-25-9-3-10-26-55)56-37-41-59(42-38-56)66(60-29-17-20-50(45-60)51-33-32-47-18-13-14-19-49(47)44-51)58-39-34-48(35-40-58)52-36-43-64-62(46-52)61-30-15-16-31-63(61)67(64)57-27-11-4-12-28-57;1-63(2)59-29-17-15-27-55(59)56-41-40-54(44-60(56)63)65(53-38-34-50(35-39-53)64(47-19-7-3-8-20-47,48-21-9-4-10-22-48)49-23-11-5-12-24-49)52-36-31-45(32-37-52)46-33-42-62-58(43-46)57-28-16-18-30-61(57)66(62)51-25-13-6-14-26-51;1-5-19-47(20-6-1)59(48-21-7-2-8-22-48,49-23-9-3-10-24-49)50-33-38-53(39-34-50)60(54-37-31-43-17-13-14-18-45(43)41-54)52-35-29-44(30-36-52)46-32-40-58-56(42-46)55-27-15-16-28-57(55)61(58)51-25-11-4-12-26-51/h1-46H;3-44H,1-2H3;1-42H |
| InChIKey | VNTIEHCBVSCKQQ-UHFFFAOYSA-N |
| XLogP | 49.19 |
| TPSA | 24.51 Ų |
| H-Bond Donors | |
| H-Bond Acceptors | 6 |
| Rotatable Bonds | 28 |
| Heavy Atoms | 194 |
| Complexity | — |
2 violations
| Rule | Value |
|---|---|
| MW ≤ 500 | 2479.20 |
| LogP ≤ 5 | 49.19 |
| H-Bond Donors ≤ 5 | 0 |
| H-Bond Acceptors ≤ 10 | 6 |
| Structural Alerts | {'alert_name': 'triphenyl_methyl-silyl', 'substructure': 'N/A'} |
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