C253H186N8 — CID 157178540
11,11-dimethyl-5-(9-phenylcarbazol-3-yl)indeno[1,2-b]carbazole;11,11-dimethyl-5-(4-phenylnaphthalen-1-yl)indeno[1,2-b]carbazole;bis(11,11-dimethyl-5-(5-phenylnaphthalen-2-yl)indeno[1,2-b]carbazole);11,11-dimethyl-5-(7-phenylnaphthalen-2-yl)indeno[1,2-b]carbazole;11,11-dimethyl-5-(3-phenylphenyl)indeno[1,2-b]carbazole;11,11-dimethyl-5-(4-phenylphenyl)indeno[1,2-b]carbazole (PubChem CID 157178540) has the molecular formula C253H186N8 and a molecular weight of 3338.33 g/mol. Its IUPAC name is 11,11-dimethyl-5-(9-phenylcarbazol-3-yl)indeno[1,2-b]carbazole;11,11-dimethyl-5-(4-phenylnaphthalen-1-yl)indeno[1,2-b]carbazole;bis(11,11-dimethyl-5-(5-phenylnaphthalen-2-yl)indeno[1,2-b]carbazole);11,11-dimethyl-5-(7-phenylnaphthalen-2-yl)indeno[1,2-b]carbazole;11,11-dimethyl-5-(3-phenylphenyl)indeno[1,2-b]carbazole;11,11-dimethyl-5-(4-phenylphenyl)indeno[1,2-b]carbazole.
| Compound Name | 11,11-dimethyl-5-(9-phenylcarbazol-3-yl)indeno[1,2-b]carbazole;11,11-dimethyl-5-(4-phenylnaphthalen-1-yl)indeno[1,2-b]carbazole;bis(11,11-dimethyl-5-(5-phenylnaphthalen-2-yl)indeno[1,2-b]carbazole);11,11-dimethyl-5-(7-phenylnaphthalen-2-yl)indeno[1,2-b]carbazole;11,11-dimethyl-5-(3-phenylphenyl)indeno[1,2-b]carbazole;11,11-dimethyl-5-(4-phenylphenyl)indeno[1,2-b]carbazole |
|---|---|
| PubChem CID | 157178540 |
| Molecular Formula | C253H186N8 |
| Molecular Weight | 3338.33 g/mol |
| Exact Mass | 3335.48 |
| IUPAC Name | 11,11-dimethyl-5-(9-phenylcarbazol-3-yl)indeno[1,2-b]carbazole;11,11-dimethyl-5-(4-phenylnaphthalen-1-yl)indeno[1,2-b]carbazole;bis(11,11-dimethyl-5-(5-phenylnaphthalen-2-yl)indeno[1,2-b]carbazole);11,11-dimethyl-5-(7-phenylnaphthalen-2-yl)indeno[1,2-b]carbazole;11,11-dimethyl-5-(3-phenylphenyl)indeno[1,2-b]carbazole;11,11-dimethyl-5-(4-phenylphenyl)indeno[1,2-b]carbazole |
| SMILES | CC1(C)c2ccccc2-c2cc3c(cc21)c1ccccc1n3-c1ccc(-c2ccccc2)c2ccccc12.CC1(C)c2ccccc2-c2cc3c(cc21)c1ccccc1n3-c1ccc(-c2ccccc2)cc1.CC1(C)c2ccccc2-c2cc3c(cc21)c1ccccc1n3-c1ccc2c(-c3ccccc3)cccc2c1.CC1(C)c2ccccc2-c2cc3c(cc21)c1ccccc1n3-c1ccc2c(-c3ccccc3)cccc2c1.CC1(C)c2ccccc2-c2cc3c(cc21)c1ccccc1n3-c1ccc2c(c1)c1ccccc1n2-c1ccccc1.CC1(C)c2ccccc2-c2cc3c(cc21)c1ccccc1n3-c1ccc2ccc(-c3ccccc3)cc2c1.CC1(C)c2ccccc2-c2cc3c(cc21)c1ccccc1n3-c1cccc(-c2ccccc2)c1 |
| InChI | InChI=1S/C39H28N2.4C37H27N.2C33H25N/c1-39(2)33-17-9-6-14-27(33)30-24-38-32(23-34(30)39)29-16-8-11-19-36(29)41(38)26-20-21-37-31(22-26)28-15-7-10-18-35(28)40(37)25-12-4-3-5-13-25;2*1-37(2)33-17-8-6-14-29(33)31-23-36-32(22-34(31)37)30-15-7-9-18-35(30)38(36)26-19-20-28-25(21-26)13-10-16-27(28)24-11-4-3-5-12-24;1-37(2)33-14-8-6-12-29(33)31-23-36-32(22-34(31)37)30-13-7-9-15-35(30)38(36)28-19-18-25-16-17-26(20-27(25)21-28)24-10-4-3-5-11-24;1-37(2)32-18-10-8-15-27(32)30-23-36-31(22-33(30)37)29-17-9-11-19-34(29)38(36)35-21-20-25(24-12-4-3-5-13-24)26-14-6-7-16-28(26)35;1-33(2)29-17-8-6-15-25(29)27-21-32-28(20-30(27)33)26-16-7-9-18-31(26)34(32)24-14-10-13-23(19-24)22-11-4-3-5-12-22;1-33(2)29-14-8-6-12-25(29)27-21-32-28(20-30(27)33)26-13-7-9-15-31(26)34(32)24-18-16-23(17-19-24)22-10-4-3-5-11-22/h3-24H,1-2H3;4*3-23H,1-2H3;2*3-21H,1-2H3 |
| InChIKey | AOHMTKGDNXGWBG-UHFFFAOYSA-N |
| XLogP | 67.34 |
| TPSA | 39.44 Ų |
| H-Bond Donors | |
| H-Bond Acceptors | 8 |
| Rotatable Bonds | 14 |
| Heavy Atoms | 261 |
| Complexity | — |
2 violations
| Rule | Value |
|---|---|
| MW ≤ 500 | 3338.33 |
| LogP ≤ 5 | 67.34 |
| H-Bond Donors ≤ 5 | 0 |
| H-Bond Acceptors ≤ 10 | 8 |