4-imidazo[1,2-a]pyridin-2-yl-N-[4-[3-[4-(N-(4-imidazo[1,2-a]pyridin-2-ylphenyl)anilino)phenyl]-6,7-bis(3-phenylphenyl)quinoxalin-2-yl]phenyl]-N-phenylaniline

C82H56N8 — CID 88592192

IUPAC4-imidazo[1,2-a]pyridin-2-yl-N-[4-[3-[4-(N-(4-imidazo[1,2-a]pyridin-2-ylphenyl)anilino)phenyl]-6,7-bis(3-phenylphenyl)quinoxalin-2-yl]phenyl]-N-phenylaniline
SMILESc1ccc(-c2cccc(-c3cc4nc(-c5ccc(N(c6ccccc6)c6ccc(-c7cn8ccccc8n7)cc6)cc5)c(-c5ccc(N(c6ccccc6)c6ccc(-c7cn8ccccc8n7)cc6)cc5)nc4cc3-c3cccc(-c4ccccc4)c3)c2)cc1
InChIInChI=1S/C82H56N8/c1-5-19-57(20-6-1)63-23-17-25-65(51-63)73-53-75-76(54-74(73)66-26-18-24-64(52-66)58-21-7-2-8-22-58)86-82(62-39-47-72(48-40-62)90(68-29-11-4-12-30-68)70-43-35-60(36-44-70)78-56-88-50-16-14-32-80(88)84-78)81(85-75)61-37-45-71(46-38-61)89(67-27-9-3-10-28-67)69-41-33-59(34-42-69)77-55-87-49-15-13-31-79(87)83-77/h1-56H
InChIKeyRINVTDVCINUBIB-UHFFFAOYSA-N
MW1153.41 g/mol
LogP21.20
Rot. Bonds14

About 4-imidazo[1,2-a]pyridin-2-yl-N-[4-[3-[4-(N-(4-imidazo[1,2-a]pyridin-2-ylphenyl)anilino)phenyl]-6,7-bis(3-phenylphenyl)quinoxalin-2-yl]phenyl]-N-phenylaniline

4-imidazo[1,2-a]pyridin-2-yl-N-[4-[3-[4-(N-(4-imidazo[1,2-a]pyridin-2-ylphenyl)anilino)phenyl]-6,7-bis(3-phenylphenyl)quinoxalin-2-yl]phenyl]-N-phenylaniline (PubChem CID 88592192) has the molecular formula C82H56N8 and a molecular weight of 1153.41 g/mol. Its IUPAC name is 4-imidazo[1,2-a]pyridin-2-yl-N-[4-[3-[4-(N-(4-imidazo[1,2-a]pyridin-2-ylphenyl)anilino)phenyl]-6,7-bis(3-phenylphenyl)quinoxalin-2-yl]phenyl]-N-phenylaniline.

Molecular Properties

Compound Name4-imidazo[1,2-a]pyridin-2-yl-N-[4-[3-[4-(N-(4-imidazo[1,2-a]pyridin-2-ylphenyl)anilino)phenyl]-6,7-bis(3-phenylphenyl)quinoxalin-2-yl]phenyl]-N-phenylaniline
PubChem CID88592192
Molecular FormulaC82H56N8
Molecular Weight1153.41 g/mol
Exact Mass1152.46
IUPAC Name4-imidazo[1,2-a]pyridin-2-yl-N-[4-[3-[4-(N-(4-imidazo[1,2-a]pyridin-2-ylphenyl)anilino)phenyl]-6,7-bis(3-phenylphenyl)quinoxalin-2-yl]phenyl]-N-phenylaniline
SMILESc1ccc(-c2cccc(-c3cc4nc(-c5ccc(N(c6ccccc6)c6ccc(-c7cn8ccccc8n7)cc6)cc5)c(-c5ccc(N(c6ccccc6)c6ccc(-c7cn8ccccc8n7)cc6)cc5)nc4cc3-c3cccc(-c4ccccc4)c3)c2)cc1
InChIInChI=1S/C82H56N8/c1-5-19-57(20-6-1)63-23-17-25-65(51-63)73-53-75-76(54-74(73)66-26-18-24-64(52-66)58-21-7-2-8-22-58)86-82(62-39-47-72(48-40-62)90(68-29-11-4-12-30-68)70-43-35-60(36-44-70)78-56-88-50-16-14-32-80(88)84-78)81(85-75)61-37-45-71(46-38-61)89(67-27-9-3-10-28-67)69-41-33-59(34-42-69)77-55-87-49-15-13-31-79(87)83-77/h1-56H
InChIKeyRINVTDVCINUBIB-UHFFFAOYSA-N
XLogP21.20
TPSA66.86 Ų
H-Bond Donors
H-Bond Acceptors8
Rotatable Bonds14
Heavy Atoms90
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 5001153.41
LogP ≤ 521.20
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 108

Analyze 4-imidazo[1,2-a]pyridin-2-yl-N-[4-[3-[4-(N-(4-imidazo[1,2-a]pyridin-2-ylphenyl)anilino)phenyl]-6,7-bis(3-phenylphenyl)quinoxalin-2-yl]phenyl]-N-phenylaniline with MolForge

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Frequently Asked Questions

What is the IUPAC name of 4-imidazo[1,2-a]pyridin-2-yl-N-[4-[3-[4-(N-(4-imidazo[1,2-a]pyridin-2-ylphenyl)anilino)phenyl]-6,7-bis(3-phenylphenyl)quinoxalin-2-yl]phenyl]-N-phenylaniline?
The IUPAC name of 4-imidazo[1,2-a]pyridin-2-yl-N-[4-[3-[4-(N-(4-imidazo[1,2-a]pyridin-2-ylphenyl)anilino)phenyl]-6,7-bis(3-phenylphenyl)quinoxalin-2-yl]phenyl]-N-phenylaniline (CID 88592192) is 4-imidazo[1,2-a]pyridin-2-yl-N-[4-[3-[4-(N-(4-imidazo[1,2-a]pyridin-2-ylphenyl)anilino)phenyl]-6,7-bis(3-phenylphenyl)quinoxalin-2-yl]phenyl]-N-phenylaniline.
What is the SMILES notation for 4-imidazo[1,2-a]pyridin-2-yl-N-[4-[3-[4-(N-(4-imidazo[1,2-a]pyridin-2-ylphenyl)anilino)phenyl]-6,7-bis(3-phenylphenyl)quinoxalin-2-yl]phenyl]-N-phenylaniline?
The canonical SMILES for 4-imidazo[1,2-a]pyridin-2-yl-N-[4-[3-[4-(N-(4-imidazo[1,2-a]pyridin-2-ylphenyl)anilino)phenyl]-6,7-bis(3-phenylphenyl)quinoxalin-2-yl]phenyl]-N-phenylaniline is c1ccc(-c2cccc(-c3cc4nc(-c5ccc(N(c6ccccc6)c6ccc(-c7cn8ccccc8n7)cc6)cc5)c(-c5ccc(N(c6ccccc6)c6ccc(-c7cn8ccccc8n7)cc6)cc5)nc4cc3-c3cccc(-c4ccccc4)c3)c2)cc1.
What is the InChIKey of 4-imidazo[1,2-a]pyridin-2-yl-N-[4-[3-[4-(N-(4-imidazo[1,2-a]pyridin-2-ylphenyl)anilino)phenyl]-6,7-bis(3-phenylphenyl)quinoxalin-2-yl]phenyl]-N-phenylaniline?
The InChIKey is RINVTDVCINUBIB-UHFFFAOYSA-N. The full InChI is InChI=1S/C82H56N8/c1-5-19-57(20-6-1)63-23-17-25-65(51-63)73-53-75-76(54-74(73)66-26-18-24-64(52-66)58-21-7-2-8-22-58)86-82(62-39-47-72(48-40-62)90(68-29-11-4-12-30-68)70-43-35-60(36-44-70)78-56-88-50-16-14-32-80(88)84-78)81(85-75)61-37-45-71(46-38-61)89(67-27-9-3-10-28-67)69-41-33-59(34-42-69)77-55-87-49-15-13-31-79(87)83-77/h1-56H.
What are the key properties of 4-imidazo[1,2-a]pyridin-2-yl-N-[4-[3-[4-(N-(4-imidazo[1,2-a]pyridin-2-ylphenyl)anilino)phenyl]-6,7-bis(3-phenylphenyl)quinoxalin-2-yl]phenyl]-N-phenylaniline?
4-imidazo[1,2-a]pyridin-2-yl-N-[4-[3-[4-(N-(4-imidazo[1,2-a]pyridin-2-ylphenyl)anilino)phenyl]-6,7-bis(3-phenylphenyl)quinoxalin-2-yl]phenyl]-N-phenylaniline has a molecular weight of 1153.41 g/mol, XLogP of 21.20, 14 rotatable bonds, 0 hydrogen bond donors, and 8 hydrogen bond acceptors.
Where does this data come from?
All data for 4-imidazo[1,2-a]pyridin-2-yl-N-[4-[3-[4-(N-(4-imidazo[1,2-a]pyridin-2-ylphenyl)anilino)phenyl]-6,7-bis(3-phenylphenyl)quinoxalin-2-yl]phenyl]-N-phenylaniline is sourced from PubChem (CID 88592192), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).