7,7-dimethyl-4-phenyl-2-[3-(9-phenylcarbazol-3-yl)phenyl]-[1]benzosilolo[2,3-h]quinazoline;7,7-dimethyl-4-phenyl-2-[3-(9-phenylcarbazol-4-yl)phenyl]-[1]benzosilolo[2,3-h]quinazoline

C92H66N6Si2 — CID 157475099

About 7,7-dimethyl-4-phenyl-2-[3-(9-phenylcarbazol-3-yl)phenyl]-[1]benzosilolo[2,3-h]quinazoline;7,7-dimethyl-4-phenyl-2-[3-(9-phenylcarbazol-4-yl)phenyl]-[1]benzosilolo[2,3-h]quinazoline

7,7-dimethyl-4-phenyl-2-[3-(9-phenylcarbazol-3-yl)phenyl]-[1]benzosilolo[2,3-h]quinazoline;7,7-dimethyl-4-phenyl-2-[3-(9-phenylcarbazol-4-yl)phenyl]-[1]benzosilolo[2,3-h]quinazoline (PubChem CID 157475099) has the molecular formula C92H66N6Si2 and a molecular weight of 1311.75 g/mol. Its IUPAC name is 7,7-dimethyl-4-phenyl-2-[3-(9-phenylcarbazol-3-yl)phenyl]-[1]benzosilolo[2,3-h]quinazoline;7,7-dimethyl-4-phenyl-2-[3-(9-phenylcarbazol-4-yl)phenyl]-[1]benzosilolo[2,3-h]quinazoline.

Molecular Properties

• Compound Name: 7,7-dimethyl-4-phenyl-2-[3-(9-phenylcarbazol-3-yl)phenyl]-[1]benzosilolo[2,3-h]quinazoline;7,7-dimethyl-4-phenyl-2-[3-(9-phenylcarbazol-4-yl)phenyl]-[1]benzosilolo[2,3-h]quinazoline
• PubChem CID: 157475099
• Molecular Formula: C92H66N6Si2
• Molecular Weight: 1311.75 g/mol
• Exact Mass: 1310.49
• IUPAC Name: 7,7-dimethyl-4-phenyl-2-[3-(9-phenylcarbazol-3-yl)phenyl]-[1]benzosilolo[2,3-h]quinazoline;7,7-dimethyl-4-phenyl-2-[3-(9-phenylcarbazol-4-yl)phenyl]-[1]benzosilolo[2,3-h]quinazoline
• SMILES: C[Si]1(C)c2ccccc2-c2c1ccc1c(-c3ccccc3)nc(-c3cccc(-c4ccc5c(c4)c4ccccc4n5-c4ccccc4)c3)nc21.C[Si]1(C)c2ccccc2-c2c1ccc1c(-c3ccccc3)nc(-c3cccc(-c4cccc5c4c4ccccc4n5-c4ccccc4)c3)nc21
• InChI: InChI=1S/2C46H33N3Si/c1-50(2)40-26-12-10-22-36(40)43-41(50)28-27-37-44(30-15-5-3-6-16-30)47-46(48-45(37)43)32-18-13-17-31(29-32)34-23-14-25-39-42(34)35-21-9-11-24-38(35)49(39)33-19-7-4-8-20-33;1-50(2)41-23-12-10-21-36(41)43-42(50)27-25-37-44(30-14-5-3-6-15-30)47-46(48-45(37)43)33-17-13-16-31(28-33)32-24-26-40-38(29-32)35-20-9-11-22-39(35)49(40)34-18-7-4-8-19-34/h2*3-29H,1-2H3
• InChIKey: BVMMUSUTUPRYRZ-UHFFFAOYSA-N
• XLogP: 21.06
• TPSA: 61.42 Ų
• H-Bond Acceptors: 6
• Rotatable Bonds: 8
• Heavy Atoms: 100
• Complexity: —

Lipinski Rule of Five

2 violations

Rule	Value
MW ≤ 500	1311.75
LogP ≤ 5	21.06
H-Bond Donors ≤ 5	0
H-Bond Acceptors ≤ 10	6

Computed Properties (RDKit)

• Structural Alerts: {'alert_name': 'heavy_metal', 'substructure': 'N/A'}

Frequently Asked Questions

What is the IUPAC name of 7,7-dimethyl-4-phenyl-2-[3-(9-phenylcarbazol-3-yl)phenyl]-[1]benzosilolo[2,3-h]quinazoline;7,7-dimethyl-4-phenyl-2-[3-(9-phenylcarbazol-4-yl)phenyl]-[1]benzosilolo[2,3-h]quinazoline?

The IUPAC name of 7,7-dimethyl-4-phenyl-2-[3-(9-phenylcarbazol-3-yl)phenyl]-[1]benzosilolo[2,3-h]quinazoline;7,7-dimethyl-4-phenyl-2-[3-(9-phenylcarbazol-4-yl)phenyl]-[1]benzosilolo[2,3-h]quinazoline (CID 157475099) is 7,7-dimethyl-4-phenyl-2-[3-(9-phenylcarbazol-3-yl)phenyl]-[1]benzosilolo[2,3-h]quinazoline;7,7-dimethyl-4-phenyl-2-[3-(9-phenylcarbazol-4-yl)phenyl]-[1]benzosilolo[2,3-h]quinazoline.

What is the SMILES notation for 7,7-dimethyl-4-phenyl-2-[3-(9-phenylcarbazol-3-yl)phenyl]-[1]benzosilolo[2,3-h]quinazoline;7,7-dimethyl-4-phenyl-2-[3-(9-phenylcarbazol-4-yl)phenyl]-[1]benzosilolo[2,3-h]quinazoline?

The canonical SMILES for 7,7-dimethyl-4-phenyl-2-[3-(9-phenylcarbazol-3-yl)phenyl]-[1]benzosilolo[2,3-h]quinazoline;7,7-dimethyl-4-phenyl-2-[3-(9-phenylcarbazol-4-yl)phenyl]-[1]benzosilolo[2,3-h]quinazoline is C[Si]1(C)c2ccccc2-c2c1ccc1c(-c3ccccc3)nc(-c3cccc(-c4ccc5c(c4)c4ccccc4n5-c4ccccc4)c3)nc21.C[Si]1(C)c2ccccc2-c2c1ccc1c(-c3ccccc3)nc(-c3cccc(-c4cccc5c4c4ccccc4n5-c4ccccc4)c3)nc21.

What is the InChIKey of 7,7-dimethyl-4-phenyl-2-[3-(9-phenylcarbazol-3-yl)phenyl]-[1]benzosilolo[2,3-h]quinazoline;7,7-dimethyl-4-phenyl-2-[3-(9-phenylcarbazol-4-yl)phenyl]-[1]benzosilolo[2,3-h]quinazoline?

The InChIKey is BVMMUSUTUPRYRZ-UHFFFAOYSA-N. The full InChI is InChI=1S/2C46H33N3Si/c1-50(2)40-26-12-10-22-36(40)43-41(50)28-27-37-44(30-15-5-3-6-16-30)47-46(48-45(37)43)32-18-13-17-31(29-32)34-23-14-25-39-42(34)35-21-9-11-24-38(35)49(39)33-19-7-4-8-20-33;1-50(2)41-23-12-10-21-36(41)43-42(50)27-25-37-44(30-14-5-3-6-15-30)47-46(48-45(37)43)33-17-13-16-31(28-33)32-24-26-40-38(29-32)35-20-9-11-22-39(35)49(40)34-18-7-4-8-19-34/h2*3-29H,1-2H3.

What are the key properties of 7,7-dimethyl-4-phenyl-2-[3-(9-phenylcarbazol-3-yl)phenyl]-[1]benzosilolo[2,3-h]quinazoline;7,7-dimethyl-4-phenyl-2-[3-(9-phenylcarbazol-4-yl)phenyl]-[1]benzosilolo[2,3-h]quinazoline?

7,7-dimethyl-4-phenyl-2-[3-(9-phenylcarbazol-3-yl)phenyl]-[1]benzosilolo[2,3-h]quinazoline;7,7-dimethyl-4-phenyl-2-[3-(9-phenylcarbazol-4-yl)phenyl]-[1]benzosilolo[2,3-h]quinazoline has a molecular weight of 1311.75 g/mol, XLogP of 21.06, 8 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.

Where does this data come from?

All data for 7,7-dimethyl-4-phenyl-2-[3-(9-phenylcarbazol-3-yl)phenyl]-[1]benzosilolo[2,3-h]quinazoline;7,7-dimethyl-4-phenyl-2-[3-(9-phenylcarbazol-4-yl)phenyl]-[1]benzosilolo[2,3-h]quinazoline is sourced from PubChem (CID 157475099), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).