2-carbazol-9-yl-7-(4-phenylquinazolin-2-yl)benzo[c]carbazole;2-carbazol-9-yl-7-quinazolin-2-ylbenzo[c]carbazole;7-[4-(9,9-dimethylfluoren-2-yl)quinazolin-2-yl]-3-(9-phenylcarbazol-2-yl)benzo[c]carbazole

C135H86N12 — CID 158731806

About 2-carbazol-9-yl-7-(4-phenylquinazolin-2-yl)benzo[c]carbazole;2-carbazol-9-yl-7-quinazolin-2-ylbenzo[c]carbazole;7-[4-(9,9-dimethylfluoren-2-yl)quinazolin-2-yl]-3-(9-phenylcarbazol-2-yl)benzo[c]carbazole

2-carbazol-9-yl-7-(4-phenylquinazolin-2-yl)benzo[c]carbazole;2-carbazol-9-yl-7-quinazolin-2-ylbenzo[c]carbazole;7-[4-(9,9-dimethylfluoren-2-yl)quinazolin-2-yl]-3-(9-phenylcarbazol-2-yl)benzo[c]carbazole (PubChem CID 158731806) has the molecular formula C135H86N12 and a molecular weight of 1876.26 g/mol. Its IUPAC name is 2-carbazol-9-yl-7-(4-phenylquinazolin-2-yl)benzo[c]carbazole;2-carbazol-9-yl-7-quinazolin-2-ylbenzo[c]carbazole;7-[4-(9,9-dimethylfluoren-2-yl)quinazolin-2-yl]-3-(9-phenylcarbazol-2-yl)benzo[c]carbazole.

Molecular Properties

• Compound Name: 2-carbazol-9-yl-7-(4-phenylquinazolin-2-yl)benzo[c]carbazole;2-carbazol-9-yl-7-quinazolin-2-ylbenzo[c]carbazole;7-[4-(9,9-dimethylfluoren-2-yl)quinazolin-2-yl]-3-(9-phenylcarbazol-2-yl)benzo[c]carbazole
• PubChem CID: 158731806
• Molecular Formula: C135H86N12
• Molecular Weight: 1876.26 g/mol
• Exact Mass: 1874.71
• IUPAC Name: 2-carbazol-9-yl-7-(4-phenylquinazolin-2-yl)benzo[c]carbazole;2-carbazol-9-yl-7-quinazolin-2-ylbenzo[c]carbazole;7-[4-(9,9-dimethylfluoren-2-yl)quinazolin-2-yl]-3-(9-phenylcarbazol-2-yl)benzo[c]carbazole
• SMILES: CC1(C)c2ccccc2-c2ccc(-c3nc(-n4c5ccccc5c5c6ccc(-c7ccc8c9ccccc9n(-c9ccccc9)c8c7)cc6ccc54)nc4ccccc34)cc21.c1ccc(-c2nc(-n3c4ccccc4c4c5cc(-n6c7ccccc7c7ccccc76)ccc5ccc43)nc3ccccc23)cc1.c1ccc2nc(-n3c4ccccc4c4c5cc(-n6c7ccccc7c7ccccc76)ccc5ccc43)ncc2c1
• InChI: InChI=1S/C57H38N4.C42H26N4.C36H22N4/c1-57(2)47-20-10-6-16-41(47)42-29-26-38(33-48(42)57)55-45-18-7-11-21-49(45)58-56(59-55)61-51-23-13-9-19-46(51)54-40-28-24-35(32-37(40)27-31-52(54)61)36-25-30-44-43-17-8-12-22-50(43)60(53(44)34-36)39-14-4-3-5-15-39;1-2-12-28(13-3-1)41-32-16-4-8-18-35(32)43-42(44-41)46-38-21-11-7-17-33(38)40-34-26-29(24-22-27(34)23-25-39(40)46)45-36-19-9-5-14-30(36)31-15-6-10-20-37(31)45;1-5-13-30-24(9-1)22-37-36(38-30)40-33-16-8-4-12-28(33)35-29-21-25(19-17-23(29)18-20-34(35)40)39-31-14-6-2-10-26(31)27-11-3-7-15-32(27)39/h3-34H,1-2H3;1-26H;1-22H
• InChIKey: ILEPOBRJXBHXCY-UHFFFAOYSA-N
• XLogP: 34.24
• TPSA: 106.92 Ų
• H-Bond Acceptors: 12
• Rotatable Bonds: 9
• Heavy Atoms: 147
• Complexity: —

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	1876.26
LogP ≤ 5	34.24
H-Bond Donors ≤ 5	0
H-Bond Acceptors ≤ 10	12

Frequently Asked Questions

What is the IUPAC name of 2-carbazol-9-yl-7-(4-phenylquinazolin-2-yl)benzo[c]carbazole;2-carbazol-9-yl-7-quinazolin-2-ylbenzo[c]carbazole;7-[4-(9,9-dimethylfluoren-2-yl)quinazolin-2-yl]-3-(9-phenylcarbazol-2-yl)benzo[c]carbazole?

The IUPAC name of 2-carbazol-9-yl-7-(4-phenylquinazolin-2-yl)benzo[c]carbazole;2-carbazol-9-yl-7-quinazolin-2-ylbenzo[c]carbazole;7-[4-(9,9-dimethylfluoren-2-yl)quinazolin-2-yl]-3-(9-phenylcarbazol-2-yl)benzo[c]carbazole (CID 158731806) is 2-carbazol-9-yl-7-(4-phenylquinazolin-2-yl)benzo[c]carbazole;2-carbazol-9-yl-7-quinazolin-2-ylbenzo[c]carbazole;7-[4-(9,9-dimethylfluoren-2-yl)quinazolin-2-yl]-3-(9-phenylcarbazol-2-yl)benzo[c]carbazole.

What is the SMILES notation for 2-carbazol-9-yl-7-(4-phenylquinazolin-2-yl)benzo[c]carbazole;2-carbazol-9-yl-7-quinazolin-2-ylbenzo[c]carbazole;7-[4-(9,9-dimethylfluoren-2-yl)quinazolin-2-yl]-3-(9-phenylcarbazol-2-yl)benzo[c]carbazole?

The canonical SMILES for 2-carbazol-9-yl-7-(4-phenylquinazolin-2-yl)benzo[c]carbazole;2-carbazol-9-yl-7-quinazolin-2-ylbenzo[c]carbazole;7-[4-(9,9-dimethylfluoren-2-yl)quinazolin-2-yl]-3-(9-phenylcarbazol-2-yl)benzo[c]carbazole is CC1(C)c2ccccc2-c2ccc(-c3nc(-n4c5ccccc5c5c6ccc(-c7ccc8c9ccccc9n(-c9ccccc9)c8c7)cc6ccc54)nc4ccccc34)cc21.c1ccc(-c2nc(-n3c4ccccc4c4c5cc(-n6c7ccccc7c7ccccc76)ccc5ccc43)nc3ccccc23)cc1.c1ccc2nc(-n3c4ccccc4c4c5cc(-n6c7ccccc7c7ccccc76)ccc5ccc43)ncc2c1.

What is the InChIKey of 2-carbazol-9-yl-7-(4-phenylquinazolin-2-yl)benzo[c]carbazole;2-carbazol-9-yl-7-quinazolin-2-ylbenzo[c]carbazole;7-[4-(9,9-dimethylfluoren-2-yl)quinazolin-2-yl]-3-(9-phenylcarbazol-2-yl)benzo[c]carbazole?

The InChIKey is ILEPOBRJXBHXCY-UHFFFAOYSA-N. The full InChI is InChI=1S/C57H38N4.C42H26N4.C36H22N4/c1-57(2)47-20-10-6-16-41(47)42-29-26-38(33-48(42)57)55-45-18-7-11-21-49(45)58-56(59-55)61-51-23-13-9-19-46(51)54-40-28-24-35(32-37(40)27-31-52(54)61)36-25-30-44-43-17-8-12-22-50(43)60(53(44)34-36)39-14-4-3-5-15-39;1-2-12-28(13-3-1)41-32-16-4-8-18-35(32)43-42(44-41)46-38-21-11-7-17-33(38)40-34-26-29(24-22-27(34)23-25-39(40)46)45-36-19-9-5-14-30(36)31-15-6-10-20-37(31)45;1-5-13-30-24(9-1)22-37-36(38-30)40-33-16-8-4-12-28(33)35-29-21-25(19-17-23(29)18-20-34(35)40)39-31-14-6-2-10-26(31)27-11-3-7-15-32(27)39/h3-34H,1-2H3;1-26H;1-22H.

What are the key properties of 2-carbazol-9-yl-7-(4-phenylquinazolin-2-yl)benzo[c]carbazole;2-carbazol-9-yl-7-quinazolin-2-ylbenzo[c]carbazole;7-[4-(9,9-dimethylfluoren-2-yl)quinazolin-2-yl]-3-(9-phenylcarbazol-2-yl)benzo[c]carbazole?

2-carbazol-9-yl-7-(4-phenylquinazolin-2-yl)benzo[c]carbazole;2-carbazol-9-yl-7-quinazolin-2-ylbenzo[c]carbazole;7-[4-(9,9-dimethylfluoren-2-yl)quinazolin-2-yl]-3-(9-phenylcarbazol-2-yl)benzo[c]carbazole has a molecular weight of 1876.26 g/mol, XLogP of 34.24, 9 rotatable bonds, 0 hydrogen bond donors, and 12 hydrogen bond acceptors.

Where does this data come from?

All data for 2-carbazol-9-yl-7-(4-phenylquinazolin-2-yl)benzo[c]carbazole;2-carbazol-9-yl-7-quinazolin-2-ylbenzo[c]carbazole;7-[4-(9,9-dimethylfluoren-2-yl)quinazolin-2-yl]-3-(9-phenylcarbazol-2-yl)benzo[c]carbazole is sourced from PubChem (CID 158731806), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).