C212H152N10 — CID 165038792
9-(2-carbazol-9-ylcyclobutyl)carbazole;9-[4-[2-(4-carbazol-9-ylphenyl)-2-adamantyl]phenyl]carbazole;9-[3-[2-[2-(3-carbazol-9-ylphenyl)phenyl]phenyl]phenyl]carbazole;9-[4-[2-[2-(4-carbazol-9-ylphenyl)phenyl]phenyl]phenyl]carbazole;9-phenyl-3-[3-(9-phenylcarbazol-3-yl)phenyl]carbazole (PubChem CID 165038792) has the molecular formula C212H152N10 and a molecular weight of 2839.62 g/mol. Its IUPAC name is 9-(2-carbazol-9-ylcyclobutyl)carbazole;9-[4-[2-(4-carbazol-9-ylphenyl)-2-adamantyl]phenyl]carbazole;9-[3-[2-[2-(3-carbazol-9-ylphenyl)phenyl]phenyl]phenyl]carbazole;9-[4-[2-[2-(4-carbazol-9-ylphenyl)phenyl]phenyl]phenyl]carbazole;9-phenyl-3-[3-(9-phenylcarbazol-3-yl)phenyl]carbazole.
| Compound Name | 9-(2-carbazol-9-ylcyclobutyl)carbazole;9-[4-[2-(4-carbazol-9-ylphenyl)-2-adamantyl]phenyl]carbazole;9-[3-[2-[2-(3-carbazol-9-ylphenyl)phenyl]phenyl]phenyl]carbazole;9-[4-[2-[2-(4-carbazol-9-ylphenyl)phenyl]phenyl]phenyl]carbazole;9-phenyl-3-[3-(9-phenylcarbazol-3-yl)phenyl]carbazole |
|---|---|
| PubChem CID | 165038792 |
| Molecular Formula | C212H152N10 |
| Molecular Weight | 2839.62 g/mol |
| Exact Mass | 2837.22 |
| IUPAC Name | 9-(2-carbazol-9-ylcyclobutyl)carbazole;9-[4-[2-(4-carbazol-9-ylphenyl)-2-adamantyl]phenyl]carbazole;9-[3-[2-[2-(3-carbazol-9-ylphenyl)phenyl]phenyl]phenyl]carbazole;9-[4-[2-[2-(4-carbazol-9-ylphenyl)phenyl]phenyl]phenyl]carbazole;9-phenyl-3-[3-(9-phenylcarbazol-3-yl)phenyl]carbazole |
| SMILES | c1cc(-c2ccccc2-c2ccccc2-c2cccc(-n3c4ccccc4c4ccccc43)c2)cc(-n2c3ccccc3c3ccccc32)c1.c1ccc(-c2ccccc2-c2ccc(-n3c4ccccc4c4ccccc43)cc2)c(-c2ccc(-n3c4ccccc4c4ccccc43)cc2)c1.c1ccc(-n2c3ccccc3c3cc(-c4cccc(-c5ccc6c(c5)c5ccccc5n6-c5ccccc5)c4)ccc32)cc1.c1ccc2c(c1)c1ccccc1n2-c1ccc(C2(c3ccc(-n4c5ccccc5c5ccccc54)cc3)C3CC4CC(C3)CC2C4)cc1.c1ccc2c(c1)c1ccccc1n2C1CCC1n1c2ccccc2c2ccccc21 |
| InChI | InChI=1S/2C48H32N2.C46H38N2.C42H28N2.C28H22N2/c1-3-21-39(37(19-1)33-15-13-17-35(31-33)49-45-27-9-5-23-41(45)42-24-6-10-28-46(42)49)40-22-4-2-20-38(40)34-16-14-18-36(32-34)50-47-29-11-7-25-43(47)44-26-8-12-30-48(44)50;1-3-15-39(37(13-1)33-25-29-35(30-26-33)49-45-21-9-5-17-41(45)42-18-6-10-22-46(42)49)40-16-4-2-14-38(40)34-27-31-36(32-28-34)50-47-23-11-7-19-43(47)44-20-8-12-24-48(44)50;1-5-13-42-38(9-1)39-10-2-6-14-43(39)47(42)36-21-17-32(18-22-36)46(34-26-30-25-31(28-34)29-35(46)27-30)33-19-23-37(24-20-33)48-44-15-7-3-11-40(44)41-12-4-8-16-45(41)48;1-3-14-33(15-4-1)43-39-20-9-7-18-35(39)37-27-31(22-24-41(37)43)29-12-11-13-30(26-29)32-23-25-42-38(28-32)36-19-8-10-21-40(36)44(42)34-16-5-2-6-17-34;1-5-13-23-19(9-1)20-10-2-6-14-24(20)29(23)27-17-18-28(27)30-25-15-7-3-11-21(25)22-12-4-8-16-26(22)30/h2*1-32H;1-24,30-31,34-35H,25-29H2;1-28H;1-16,27-28H,17-18H2 |
| InChIKey | NULOUUMNSNFVCZ-UHFFFAOYSA-N |
| XLogP | 56.08 |
| TPSA | 49.30 Ų |
| H-Bond Donors | |
| H-Bond Acceptors | 10 |
| Rotatable Bonds | 20 |
| Heavy Atoms | 222 |
| Complexity | — |
2 violations
| Rule | Value |
|---|---|
| MW ≤ 500 | 2839.62 |
| LogP ≤ 5 | 56.08 |
| H-Bond Donors ≤ 5 | 0 |
| H-Bond Acceptors ≤ 10 | 10 |