C180H132N8 — CID 158730549
5-(9,9-dimethylfluoren-2-yl)-12-(9,9-dimethylfluoren-4-yl)indolo[3,2-c]carbazole;12-(9,9-dimethylfluoren-1-yl)-5-(9,9-dimethylfluoren-2-yl)indolo[3,2-c]carbazole;5-(9,9-dimethylfluoren-2-yl)-12-phenylindolo[3,2-c]carbazole;5-(9,9-dimethylfluoren-2-yl)-12-(4-phenylphenyl)indolo[3,2-c]carbazole (PubChem CID 158730549) has the molecular formula C180H132N8 and a molecular weight of 2407.09 g/mol. Its IUPAC name is 5-(9,9-dimethylfluoren-2-yl)-12-(9,9-dimethylfluoren-4-yl)indolo[3,2-c]carbazole;12-(9,9-dimethylfluoren-1-yl)-5-(9,9-dimethylfluoren-2-yl)indolo[3,2-c]carbazole;5-(9,9-dimethylfluoren-2-yl)-12-phenylindolo[3,2-c]carbazole;5-(9,9-dimethylfluoren-2-yl)-12-(4-phenylphenyl)indolo[3,2-c]carbazole.
| Compound Name | 5-(9,9-dimethylfluoren-2-yl)-12-(9,9-dimethylfluoren-4-yl)indolo[3,2-c]carbazole;12-(9,9-dimethylfluoren-1-yl)-5-(9,9-dimethylfluoren-2-yl)indolo[3,2-c]carbazole;5-(9,9-dimethylfluoren-2-yl)-12-phenylindolo[3,2-c]carbazole;5-(9,9-dimethylfluoren-2-yl)-12-(4-phenylphenyl)indolo[3,2-c]carbazole |
|---|---|
| PubChem CID | 158730549 |
| Molecular Formula | C180H132N8 |
| Molecular Weight | 2407.09 g/mol |
| Exact Mass | 2405.06 |
| IUPAC Name | 5-(9,9-dimethylfluoren-2-yl)-12-(9,9-dimethylfluoren-4-yl)indolo[3,2-c]carbazole;12-(9,9-dimethylfluoren-1-yl)-5-(9,9-dimethylfluoren-2-yl)indolo[3,2-c]carbazole;5-(9,9-dimethylfluoren-2-yl)-12-phenylindolo[3,2-c]carbazole;5-(9,9-dimethylfluoren-2-yl)-12-(4-phenylphenyl)indolo[3,2-c]carbazole |
| SMILES | CC1(C)c2ccccc2-c2ccc(-n3c4ccccc4c4c3ccc3c5ccccc5n(-c5ccc(-c6ccccc6)cc5)c34)cc21.CC1(C)c2ccccc2-c2ccc(-n3c4ccccc4c4c3ccc3c5ccccc5n(-c5cccc6c5-c5ccccc5C6(C)C)c34)cc21.CC1(C)c2ccccc2-c2ccc(-n3c4ccccc4c4c3ccc3c5ccccc5n(-c5cccc6c5C(C)(C)c5ccccc5-6)c34)cc21.CC1(C)c2ccccc2-c2ccc(-n3c4ccccc4c4c3ccc3c5ccccc5n(-c5ccccc5)c34)cc21 |
| InChI | InChI=1S/2C48H36N2.C45H32N2.C39H28N2/c1-47(2)37-19-10-6-16-34(37)44-38(47)20-13-23-42(44)50-40-21-11-7-15-32(40)33-26-27-43-45(46(33)50)35-17-8-12-22-41(35)49(43)29-24-25-31-30-14-5-9-18-36(30)48(3,4)39(31)28-29;1-47(2)37-19-9-5-14-30(37)32-25-24-29(28-39(32)47)49-41-22-12-8-17-36(41)44-42(49)27-26-35-33-16-7-11-21-40(33)50(46(35)44)43-23-13-18-34-31-15-6-10-20-38(31)48(3,4)45(34)43;1-45(2)38-17-9-6-14-33(38)34-25-24-32(28-39(34)45)46-41-19-11-8-16-37(41)43-42(46)27-26-36-35-15-7-10-18-40(35)47(44(36)43)31-22-20-30(21-23-31)29-12-4-3-5-13-29;1-39(2)32-17-9-6-14-27(32)28-21-20-26(24-33(28)39)40-35-19-11-8-16-31(35)37-36(40)23-22-30-29-15-7-10-18-34(29)41(38(30)37)25-12-4-3-5-13-25/h2*5-28H,1-4H3;3-28H,1-2H3;3-24H,1-2H3 |
| InChIKey | ILAUZRLBSGNAJB-UHFFFAOYSA-N |
| XLogP | 47.03 |
| TPSA | 39.44 Ų |
| H-Bond Donors | |
| H-Bond Acceptors | 8 |
| Rotatable Bonds | 9 |
| Heavy Atoms | 188 |
| Complexity | — |
2 violations
| Rule | Value |
|---|---|
| MW ≤ 500 | 2407.09 |
| LogP ≤ 5 | 47.03 |
| H-Bond Donors ≤ 5 | 0 |
| H-Bond Acceptors ≤ 10 | 8 |