3-[4-(9-methylcarbazol-2-yl)phenyl]phenanthro[9,10-b]pyrazine;3-[2-(9-phenylcarbazol-2-yl)phenyl]phenanthro[9,10-b]pyrazine;3-[4-(9-phenylcarbazol-2-yl)phenyl]phenanthro[9,10-b]pyrazine

C115H73N9 — CID 159778917

About 3-[4-(9-methylcarbazol-2-yl)phenyl]phenanthro[9,10-b]pyrazine;3-[2-(9-phenylcarbazol-2-yl)phenyl]phenanthro[9,10-b]pyrazine;3-[4-(9-phenylcarbazol-2-yl)phenyl]phenanthro[9,10-b]pyrazine

3-[4-(9-methylcarbazol-2-yl)phenyl]phenanthro[9,10-b]pyrazine;3-[2-(9-phenylcarbazol-2-yl)phenyl]phenanthro[9,10-b]pyrazine;3-[4-(9-phenylcarbazol-2-yl)phenyl]phenanthro[9,10-b]pyrazine (PubChem CID 159778917) has the molecular formula C115H73N9 and a molecular weight of 1580.91 g/mol. Its IUPAC name is 3-[4-(9-methylcarbazol-2-yl)phenyl]phenanthro[9,10-b]pyrazine;3-[2-(9-phenylcarbazol-2-yl)phenyl]phenanthro[9,10-b]pyrazine;3-[4-(9-phenylcarbazol-2-yl)phenyl]phenanthro[9,10-b]pyrazine.

Molecular Properties

• Compound Name: 3-[4-(9-methylcarbazol-2-yl)phenyl]phenanthro[9,10-b]pyrazine;3-[2-(9-phenylcarbazol-2-yl)phenyl]phenanthro[9,10-b]pyrazine;3-[4-(9-phenylcarbazol-2-yl)phenyl]phenanthro[9,10-b]pyrazine
• PubChem CID: 159778917
• Molecular Formula: C115H73N9
• Molecular Weight: 1580.91 g/mol
• Exact Mass: 1579.60
• IUPAC Name: 3-[4-(9-methylcarbazol-2-yl)phenyl]phenanthro[9,10-b]pyrazine;3-[2-(9-phenylcarbazol-2-yl)phenyl]phenanthro[9,10-b]pyrazine;3-[4-(9-phenylcarbazol-2-yl)phenyl]phenanthro[9,10-b]pyrazine
• SMILES: Cn1c2ccccc2c2ccc(-c3ccc(-c4cnc5c6ccccc6c6ccccc6c5n4)cc3)cc21.c1ccc(-n2c3ccccc3c3ccc(-c4ccc(-c5cnc6c7ccccc7c7ccccc7c6n5)cc4)cc32)cc1.c1ccc(-n2c3ccccc3c3ccc(-c4ccccc4-c4cnc5c6ccccc6c6ccccc6c5n4)cc32)cc1
• InChI: InChI=1S/2C40H25N3.C35H23N3/c1-2-12-27(13-3-1)43-37-21-11-10-18-32(37)33-23-22-26(24-38(33)43)28-14-4-7-17-31(28)36-25-41-39-34-19-8-5-15-29(34)30-16-6-9-20-35(30)40(39)42-36;1-2-10-29(11-3-1)43-37-17-9-8-14-32(37)33-23-22-28(24-38(33)43)26-18-20-27(21-19-26)36-25-41-39-34-15-6-4-12-30(34)31-13-5-7-16-35(31)40(39)42-36;1-38-32-13-7-6-10-27(32)28-19-18-24(20-33(28)38)22-14-16-23(17-15-22)31-21-36-34-29-11-4-2-8-25(29)26-9-3-5-12-30(26)35(34)37-31/h2*1-25H;2-21H,1H3
• InChIKey: NHCKPBCGAPCOJB-UHFFFAOYSA-N
• XLogP: 29.65
• TPSA: 92.13 Ų
• H-Bond Acceptors: 9
• Rotatable Bonds: 8
• Heavy Atoms: 124
• Complexity: —

Lipinski Rule of Five

2 violations

Rule	Value
MW ≤ 500	1580.91
LogP ≤ 5	29.65
H-Bond Donors ≤ 5	0
H-Bond Acceptors ≤ 10	9

Computed Properties (RDKit)

• Structural Alerts: {'alert_name': 'Polycyclic_aromatic_hydrocarbon_3', 'substructure': 'N/A'}

Frequently Asked Questions

What is the IUPAC name of 3-[4-(9-methylcarbazol-2-yl)phenyl]phenanthro[9,10-b]pyrazine;3-[2-(9-phenylcarbazol-2-yl)phenyl]phenanthro[9,10-b]pyrazine;3-[4-(9-phenylcarbazol-2-yl)phenyl]phenanthro[9,10-b]pyrazine?

The IUPAC name of 3-[4-(9-methylcarbazol-2-yl)phenyl]phenanthro[9,10-b]pyrazine;3-[2-(9-phenylcarbazol-2-yl)phenyl]phenanthro[9,10-b]pyrazine;3-[4-(9-phenylcarbazol-2-yl)phenyl]phenanthro[9,10-b]pyrazine (CID 159778917) is 3-[4-(9-methylcarbazol-2-yl)phenyl]phenanthro[9,10-b]pyrazine;3-[2-(9-phenylcarbazol-2-yl)phenyl]phenanthro[9,10-b]pyrazine;3-[4-(9-phenylcarbazol-2-yl)phenyl]phenanthro[9,10-b]pyrazine.

What is the SMILES notation for 3-[4-(9-methylcarbazol-2-yl)phenyl]phenanthro[9,10-b]pyrazine;3-[2-(9-phenylcarbazol-2-yl)phenyl]phenanthro[9,10-b]pyrazine;3-[4-(9-phenylcarbazol-2-yl)phenyl]phenanthro[9,10-b]pyrazine?

The canonical SMILES for 3-[4-(9-methylcarbazol-2-yl)phenyl]phenanthro[9,10-b]pyrazine;3-[2-(9-phenylcarbazol-2-yl)phenyl]phenanthro[9,10-b]pyrazine;3-[4-(9-phenylcarbazol-2-yl)phenyl]phenanthro[9,10-b]pyrazine is Cn1c2ccccc2c2ccc(-c3ccc(-c4cnc5c6ccccc6c6ccccc6c5n4)cc3)cc21.c1ccc(-n2c3ccccc3c3ccc(-c4ccc(-c5cnc6c7ccccc7c7ccccc7c6n5)cc4)cc32)cc1.c1ccc(-n2c3ccccc3c3ccc(-c4ccccc4-c4cnc5c6ccccc6c6ccccc6c5n4)cc32)cc1.

What is the InChIKey of 3-[4-(9-methylcarbazol-2-yl)phenyl]phenanthro[9,10-b]pyrazine;3-[2-(9-phenylcarbazol-2-yl)phenyl]phenanthro[9,10-b]pyrazine;3-[4-(9-phenylcarbazol-2-yl)phenyl]phenanthro[9,10-b]pyrazine?

The InChIKey is NHCKPBCGAPCOJB-UHFFFAOYSA-N. The full InChI is InChI=1S/2C40H25N3.C35H23N3/c1-2-12-27(13-3-1)43-37-21-11-10-18-32(37)33-23-22-26(24-38(33)43)28-14-4-7-17-31(28)36-25-41-39-34-19-8-5-15-29(34)30-16-6-9-20-35(30)40(39)42-36;1-2-10-29(11-3-1)43-37-17-9-8-14-32(37)33-23-22-28(24-38(33)43)26-18-20-27(21-19-26)36-25-41-39-34-15-6-4-12-30(34)31-13-5-7-16-35(31)40(39)42-36;1-38-32-13-7-6-10-27(32)28-19-18-24(20-33(28)38)22-14-16-23(17-15-22)31-21-36-34-29-11-4-2-8-25(29)26-9-3-5-12-30(26)35(34)37-31/h2*1-25H;2-21H,1H3.

What are the key properties of 3-[4-(9-methylcarbazol-2-yl)phenyl]phenanthro[9,10-b]pyrazine;3-[2-(9-phenylcarbazol-2-yl)phenyl]phenanthro[9,10-b]pyrazine;3-[4-(9-phenylcarbazol-2-yl)phenyl]phenanthro[9,10-b]pyrazine?

3-[4-(9-methylcarbazol-2-yl)phenyl]phenanthro[9,10-b]pyrazine;3-[2-(9-phenylcarbazol-2-yl)phenyl]phenanthro[9,10-b]pyrazine;3-[4-(9-phenylcarbazol-2-yl)phenyl]phenanthro[9,10-b]pyrazine has a molecular weight of 1580.91 g/mol, XLogP of 29.65, 8 rotatable bonds, 0 hydrogen bond donors, and 9 hydrogen bond acceptors.

Where does this data come from?

All data for 3-[4-(9-methylcarbazol-2-yl)phenyl]phenanthro[9,10-b]pyrazine;3-[2-(9-phenylcarbazol-2-yl)phenyl]phenanthro[9,10-b]pyrazine;3-[4-(9-phenylcarbazol-2-yl)phenyl]phenanthro[9,10-b]pyrazine is sourced from PubChem (CID 159778917), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).