4-imidazo[1,2-a]pyridin-2-yl-N-[4-[3-[4-(N-(4-imidazo[1,2-a]pyridin-2-ylphenyl)anilino)phenyl]-5,8-bis(2,4,6-trimethylphenyl)quinoxalin-2-yl]phenyl]-N-phenylaniline

C76H60N8 — CID 88592198

IUPAC4-imidazo[1,2-a]pyridin-2-yl-N-[4-[3-[4-(N-(4-imidazo[1,2-a]pyridin-2-ylphenyl)anilino)phenyl]-5,8-bis(2,4,6-trimethylphenyl)quinoxalin-2-yl]phenyl]-N-phenylaniline
SMILESCc1cc(C)c(-c2ccc(-c3c(C)cc(C)cc3C)c3nc(-c4ccc(N(c5ccccc5)c5ccc(-c6cn7ccccc7n6)cc5)cc4)c(-c4ccc(N(c5ccccc5)c5ccc(-c6cn7ccccc7n6)cc5)cc4)nc23)c(C)c1
InChIInChI=1S/C76H60N8/c1-49-43-51(3)71(52(4)44-49)65-39-40-66(72-53(5)45-50(2)46-54(72)6)76-75(65)79-73(57-27-35-63(36-28-57)83(59-17-9-7-10-18-59)61-31-23-55(24-32-61)67-47-81-41-15-13-21-69(81)77-67)74(80-76)58-29-37-64(38-30-58)84(60-19-11-8-12-20-60)62-33-25-56(26-34-62)68-48-82-42-16-14-22-70(82)78-68/h7-48H,1-6H3
InChIKeyVJGSYAFXLBTDMA-UHFFFAOYSA-N
MW1085.37 g/mol
LogP19.72
Rot. Bonds12

About 4-imidazo[1,2-a]pyridin-2-yl-N-[4-[3-[4-(N-(4-imidazo[1,2-a]pyridin-2-ylphenyl)anilino)phenyl]-5,8-bis(2,4,6-trimethylphenyl)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]-5,8-bis(2,4,6-trimethylphenyl)quinoxalin-2-yl]phenyl]-N-phenylaniline (PubChem CID 88592198) has the molecular formula C76H60N8 and a molecular weight of 1085.37 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]-5,8-bis(2,4,6-trimethylphenyl)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]-5,8-bis(2,4,6-trimethylphenyl)quinoxalin-2-yl]phenyl]-N-phenylaniline
PubChem CID88592198
Molecular FormulaC76H60N8
Molecular Weight1085.37 g/mol
Exact Mass1084.49
IUPAC Name4-imidazo[1,2-a]pyridin-2-yl-N-[4-[3-[4-(N-(4-imidazo[1,2-a]pyridin-2-ylphenyl)anilino)phenyl]-5,8-bis(2,4,6-trimethylphenyl)quinoxalin-2-yl]phenyl]-N-phenylaniline
SMILESCc1cc(C)c(-c2ccc(-c3c(C)cc(C)cc3C)c3nc(-c4ccc(N(c5ccccc5)c5ccc(-c6cn7ccccc7n6)cc5)cc4)c(-c4ccc(N(c5ccccc5)c5ccc(-c6cn7ccccc7n6)cc5)cc4)nc23)c(C)c1
InChIInChI=1S/C76H60N8/c1-49-43-51(3)71(52(4)44-49)65-39-40-66(72-53(5)45-50(2)46-54(72)6)76-75(65)79-73(57-27-35-63(36-28-57)83(59-17-9-7-10-18-59)61-31-23-55(24-32-61)67-47-81-41-15-13-21-69(81)77-67)74(80-76)58-29-37-64(38-30-58)84(60-19-11-8-12-20-60)62-33-25-56(26-34-62)68-48-82-42-16-14-22-70(82)78-68/h7-48H,1-6H3
InChIKeyVJGSYAFXLBTDMA-UHFFFAOYSA-N
XLogP19.72
TPSA66.86 Ų
H-Bond Donors
H-Bond Acceptors8
Rotatable Bonds12
Heavy Atoms84
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 5001085.37
LogP ≤ 519.72
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]-5,8-bis(2,4,6-trimethylphenyl)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]-5,8-bis(2,4,6-trimethylphenyl)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]-5,8-bis(2,4,6-trimethylphenyl)quinoxalin-2-yl]phenyl]-N-phenylaniline (CID 88592198) is 4-imidazo[1,2-a]pyridin-2-yl-N-[4-[3-[4-(N-(4-imidazo[1,2-a]pyridin-2-ylphenyl)anilino)phenyl]-5,8-bis(2,4,6-trimethylphenyl)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]-5,8-bis(2,4,6-trimethylphenyl)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]-5,8-bis(2,4,6-trimethylphenyl)quinoxalin-2-yl]phenyl]-N-phenylaniline is Cc1cc(C)c(-c2ccc(-c3c(C)cc(C)cc3C)c3nc(-c4ccc(N(c5ccccc5)c5ccc(-c6cn7ccccc7n6)cc5)cc4)c(-c4ccc(N(c5ccccc5)c5ccc(-c6cn7ccccc7n6)cc5)cc4)nc23)c(C)c1.
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]-5,8-bis(2,4,6-trimethylphenyl)quinoxalin-2-yl]phenyl]-N-phenylaniline?
The InChIKey is VJGSYAFXLBTDMA-UHFFFAOYSA-N. The full InChI is InChI=1S/C76H60N8/c1-49-43-51(3)71(52(4)44-49)65-39-40-66(72-53(5)45-50(2)46-54(72)6)76-75(65)79-73(57-27-35-63(36-28-57)83(59-17-9-7-10-18-59)61-31-23-55(24-32-61)67-47-81-41-15-13-21-69(81)77-67)74(80-76)58-29-37-64(38-30-58)84(60-19-11-8-12-20-60)62-33-25-56(26-34-62)68-48-82-42-16-14-22-70(82)78-68/h7-48H,1-6H3.
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]-5,8-bis(2,4,6-trimethylphenyl)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]-5,8-bis(2,4,6-trimethylphenyl)quinoxalin-2-yl]phenyl]-N-phenylaniline has a molecular weight of 1085.37 g/mol, XLogP of 19.72, 12 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]-5,8-bis(2,4,6-trimethylphenyl)quinoxalin-2-yl]phenyl]-N-phenylaniline is sourced from PubChem (CID 88592198), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).