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(2-phenylphenyl)quinoxalin-2-yl]phenyl]-N-phenylaniline

C82H56N8 — CID 88592190

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(2-phenylphenyl)quinoxalin-2-yl]phenyl]-N-phenylaniline
SMILESc1ccc(-c2ccccc2-c2cc3nc(-c4ccc(N(c5ccccc5)c5ccc(-c6cn7ccccc7n6)cc5)cc4)c(-c4ccc(N(c5ccccc5)c5ccc(-c6cn7ccccc7n6)cc5)cc4)nc3cc2-c2ccccc2-c2ccccc2)cc1
InChIInChI=1S/C82H56N8/c1-5-21-57(22-6-1)69-29-13-15-31-71(69)73-53-75-76(54-74(73)72-32-16-14-30-70(72)58-23-7-2-8-24-58)86-82(62-41-49-68(50-42-62)90(64-27-11-4-12-28-64)66-45-37-60(38-46-66)78-56-88-52-20-18-34-80(88)84-78)81(85-75)61-39-47-67(48-40-61)89(63-25-9-3-10-26-63)65-43-35-59(36-44-65)77-55-87-51-19-17-33-79(87)83-77/h1-56H
InChIKeyIZAMUZGHGULASZ-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(2-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(2-phenylphenyl)quinoxalin-2-yl]phenyl]-N-phenylaniline (PubChem CID 88592190) 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(2-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(2-phenylphenyl)quinoxalin-2-yl]phenyl]-N-phenylaniline
PubChem CID88592190
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(2-phenylphenyl)quinoxalin-2-yl]phenyl]-N-phenylaniline
SMILESc1ccc(-c2ccccc2-c2cc3nc(-c4ccc(N(c5ccccc5)c5ccc(-c6cn7ccccc7n6)cc5)cc4)c(-c4ccc(N(c5ccccc5)c5ccc(-c6cn7ccccc7n6)cc5)cc4)nc3cc2-c2ccccc2-c2ccccc2)cc1
InChIInChI=1S/C82H56N8/c1-5-21-57(22-6-1)69-29-13-15-31-71(69)73-53-75-76(54-74(73)72-32-16-14-30-70(72)58-23-7-2-8-24-58)86-82(62-41-49-68(50-42-62)90(64-27-11-4-12-28-64)66-45-37-60(38-46-66)78-56-88-52-20-18-34-80(88)84-78)81(85-75)61-39-47-67(48-40-61)89(63-25-9-3-10-26-63)65-43-35-59(36-44-65)77-55-87-51-19-17-33-79(87)83-77/h1-56H
InChIKeyIZAMUZGHGULASZ-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(2-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(2-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(2-phenylphenyl)quinoxalin-2-yl]phenyl]-N-phenylaniline (CID 88592190) 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(2-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(2-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(2-phenylphenyl)quinoxalin-2-yl]phenyl]-N-phenylaniline is c1ccc(-c2ccccc2-c2cc3nc(-c4ccc(N(c5ccccc5)c5ccc(-c6cn7ccccc7n6)cc5)cc4)c(-c4ccc(N(c5ccccc5)c5ccc(-c6cn7ccccc7n6)cc5)cc4)nc3cc2-c2ccccc2-c2ccccc2)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(2-phenylphenyl)quinoxalin-2-yl]phenyl]-N-phenylaniline?
The InChIKey is IZAMUZGHGULASZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C82H56N8/c1-5-21-57(22-6-1)69-29-13-15-31-71(69)73-53-75-76(54-74(73)72-32-16-14-30-70(72)58-23-7-2-8-24-58)86-82(62-41-49-68(50-42-62)90(64-27-11-4-12-28-64)66-45-37-60(38-46-66)78-56-88-52-20-18-34-80(88)84-78)81(85-75)61-39-47-67(48-40-61)89(63-25-9-3-10-26-63)65-43-35-59(36-44-65)77-55-87-51-19-17-33-79(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(2-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(2-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(2-phenylphenyl)quinoxalin-2-yl]phenyl]-N-phenylaniline is sourced from PubChem (CID 88592190), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).