C318H222N6 — CID 158478132
9-[9,10-bis(5,6,7,8-tetrahydronaphthalen-1-yl)anthracen-2-yl]carbazole;9-[9,10-bis(2,4,6-trimethylphenyl)anthracen-2-yl]carbazole;9-(9,10-diphenylanthracen-2-yl)-3,6-bis(4-phenylphenyl)carbazole;9-(9,10-diphenylanthracen-2-yl)-3,6-dinaphthalen-1-ylcarbazole;9-(9,10-diphenylanthracen-2-yl)-3,6-dinaphthalen-2-ylcarbazole;9-(9,10-diphenylanthracen-2-yl)-3,6-diphenylcarbazole (PubChem CID 158478132) has the molecular formula C318H222N6 and a molecular weight of 4127.32 g/mol. Its IUPAC name is 9-[9,10-bis(5,6,7,8-tetrahydronaphthalen-1-yl)anthracen-2-yl]carbazole;9-[9,10-bis(2,4,6-trimethylphenyl)anthracen-2-yl]carbazole;9-(9,10-diphenylanthracen-2-yl)-3,6-bis(4-phenylphenyl)carbazole;9-(9,10-diphenylanthracen-2-yl)-3,6-dinaphthalen-1-ylcarbazole;9-(9,10-diphenylanthracen-2-yl)-3,6-dinaphthalen-2-ylcarbazole;9-(9,10-diphenylanthracen-2-yl)-3,6-diphenylcarbazole.
| Compound Name | 9-[9,10-bis(5,6,7,8-tetrahydronaphthalen-1-yl)anthracen-2-yl]carbazole;9-[9,10-bis(2,4,6-trimethylphenyl)anthracen-2-yl]carbazole;9-(9,10-diphenylanthracen-2-yl)-3,6-bis(4-phenylphenyl)carbazole;9-(9,10-diphenylanthracen-2-yl)-3,6-dinaphthalen-1-ylcarbazole;9-(9,10-diphenylanthracen-2-yl)-3,6-dinaphthalen-2-ylcarbazole;9-(9,10-diphenylanthracen-2-yl)-3,6-diphenylcarbazole |
|---|---|
| PubChem CID | 158478132 |
| Molecular Formula | C318H222N6 |
| Molecular Weight | 4127.32 g/mol |
| Exact Mass | 4123.76 |
| IUPAC Name | 9-[9,10-bis(5,6,7,8-tetrahydronaphthalen-1-yl)anthracen-2-yl]carbazole;9-[9,10-bis(2,4,6-trimethylphenyl)anthracen-2-yl]carbazole;9-(9,10-diphenylanthracen-2-yl)-3,6-bis(4-phenylphenyl)carbazole;9-(9,10-diphenylanthracen-2-yl)-3,6-dinaphthalen-1-ylcarbazole;9-(9,10-diphenylanthracen-2-yl)-3,6-dinaphthalen-2-ylcarbazole;9-(9,10-diphenylanthracen-2-yl)-3,6-diphenylcarbazole |
| SMILES | Cc1cc(C)c(-c2c3ccccc3c(-c3c(C)cc(C)cc3C)c3cc(-n4c5ccccc5c5ccccc54)ccc23)c(C)c1.c1cc2c(c(-c3c4ccccc4c(-c4cccc5c4CCCC5)c4cc(-n5c6ccccc6c6ccccc65)ccc34)c1)CCCC2.c1ccc(-c2c3ccccc3c(-c3ccccc3)c3cc(-n4c5ccc(-c6ccc7ccccc7c6)cc5c5cc(-c6ccc7ccccc7c6)ccc54)ccc23)cc1.c1ccc(-c2c3ccccc3c(-c3ccccc3)c3cc(-n4c5ccc(-c6cccc7ccccc67)cc5c5cc(-c6cccc7ccccc67)ccc54)ccc23)cc1.c1ccc(-c2ccc(-c3ccc4c(c3)c3cc(-c5ccc(-c6ccccc6)cc5)ccc3n4-c3ccc4c(-c5ccccc5)c5ccccc5c(-c5ccccc5)c4c3)cc2)cc1.c1ccc(-c2ccc3c(c2)c2cc(-c4ccccc4)ccc2n3-c2ccc3c(-c4ccccc4)c4ccccc4c(-c4ccccc4)c3c2)cc1 |
| InChI | InChI=1S/C62H41N.2C58H37N.C50H33N.C46H37N.C44H37N/c1-5-15-42(16-6-1)44-25-29-46(30-26-44)50-33-37-59-56(39-50)57-40-51(47-31-27-45(28-32-47)43-17-7-2-8-18-43)34-38-60(57)63(59)52-35-36-55-58(41-52)62(49-21-11-4-12-22-49)54-24-14-13-23-53(54)61(55)48-19-9-3-10-20-48;1-3-17-40(18-4-1)57-49-25-11-12-26-50(49)58(41-19-5-2-6-20-41)54-37-44(31-32-51(54)57)59-55-33-29-42(47-27-13-21-38-15-7-9-23-45(38)47)35-52(55)53-36-43(30-34-56(53)59)48-28-14-22-39-16-8-10-24-46(39)48;1-3-15-40(16-4-1)57-49-21-11-12-22-50(49)58(41-17-5-2-6-18-41)54-37-48(29-30-51(54)57)59-55-31-27-46(44-25-23-38-13-7-9-19-42(38)33-44)35-52(55)53-36-47(28-32-56(53)59)45-26-24-39-14-8-10-20-43(39)34-45;1-5-15-34(16-6-1)38-25-29-47-44(31-38)45-32-39(35-17-7-2-8-18-35)26-30-48(45)51(47)40-27-28-43-46(33-40)50(37-21-11-4-12-22-37)42-24-14-13-23-41(42)49(43)36-19-9-3-10-20-36;1-3-17-33-30(13-1)15-11-23-37(33)45-39-21-5-6-22-40(39)46(38-24-12-16-31-14-2-4-18-34(31)38)42-29-32(27-28-41(42)45)47-43-25-9-7-19-35(43)36-20-8-10-26-44(36)47;1-26-21-28(3)41(29(4)22-26)43-35-15-7-8-16-36(35)44(42-30(5)23-27(2)24-31(42)6)38-25-32(19-20-37(38)43)45-39-17-11-9-13-33(39)34-14-10-12-18-40(34)45/h1-41H;2*1-37H;1-33H;5-12,15-16,19-29H,1-4,13-14,17-18H2;7-25H,1-6H3 |
| InChIKey | HHEOKIIBIBISSZ-UHFFFAOYSA-N |
| XLogP | 87.44 |
| TPSA | 29.58 Ų |
| H-Bond Donors | |
| H-Bond Acceptors | 6 |
| Rotatable Bonds | 28 |
| Heavy Atoms | 324 |
| Complexity | — |
2 violations
| Rule | Value |
|---|---|
| MW ≤ 500 | 4127.32 |
| LogP ≤ 5 | 87.44 |
| H-Bond Donors ≤ 5 | 0 |
| H-Bond Acceptors ≤ 10 | 6 |