2-[4-[2-[3-chloro-5-[5-[6-[4-[2-[3-chloro-5-[2-(4-pyridin-2-ylphenyl)phenyl]phenyl]phenyl]phenyl]-3-pyridinyl]-2-(4-quinolin-2-ylphenyl)phenyl]phenyl]phenyl]phenyl]quinoline

C88H56Cl2N4 — CID 126638747

IUPAC2-[4-[2-[3-chloro-5-[5-[6-[4-[2-[3-chloro-5-[2-(4-pyridin-2-ylphenyl)phenyl]phenyl]phenyl]phenyl]-3-pyridinyl]-2-(4-quinolin-2-ylphenyl)phenyl]phenyl]phenyl]phenyl]quinoline
SMILESClc1cc(-c2ccccc2-c2ccc(-c3ccccn3)cc2)cc(-c2ccccc2-c2ccc(-c3ccc(-c4ccc(-c5ccc(-c6ccc7ccccc7n6)cc5)c(-c5cc(Cl)cc(-c6ccccc6-c6ccc(-c7ccc8ccccc8n7)cc6)c5)c4)cn3)cc2)c1
InChIInChI=1S/C88H56Cl2N4/c89-73-51-69(78-18-6-3-15-75(78)57-24-32-63(33-25-57)83-21-11-12-48-91-83)49-70(52-73)79-19-7-4-16-76(79)58-26-34-64(35-27-58)84-45-43-68(56-92-84)67-40-44-81(60-30-38-66(39-31-60)88-47-42-62-14-2-10-23-86(62)94-88)82(55-67)72-50-71(53-74(90)54-72)80-20-8-5-17-77(80)59-28-36-65(37-29-59)87-46-41-61-13-1-9-22-85(61)93-87/h1-56H
InChIKeyBUOLNOBRURBYBE-UHFFFAOYSA-N
MW1240.35 g/mol
LogP24.55
Rot. Bonds13

About 2-[4-[2-[3-chloro-5-[5-[6-[4-[2-[3-chloro-5-[2-(4-pyridin-2-ylphenyl)phenyl]phenyl]phenyl]phenyl]-3-pyridinyl]-2-(4-quinolin-2-ylphenyl)phenyl]phenyl]phenyl]phenyl]quinoline

2-[4-[2-[3-chloro-5-[5-[6-[4-[2-[3-chloro-5-[2-(4-pyridin-2-ylphenyl)phenyl]phenyl]phenyl]phenyl]-3-pyridinyl]-2-(4-quinolin-2-ylphenyl)phenyl]phenyl]phenyl]phenyl]quinoline (PubChem CID 126638747) has the molecular formula C88H56Cl2N4 and a molecular weight of 1240.35 g/mol. Its IUPAC name is 2-[4-[2-[3-chloro-5-[5-[6-[4-[2-[3-chloro-5-[2-(4-pyridin-2-ylphenyl)phenyl]phenyl]phenyl]phenyl]-3-pyridinyl]-2-(4-quinolin-2-ylphenyl)phenyl]phenyl]phenyl]phenyl]quinoline.

Molecular Properties

Compound Name2-[4-[2-[3-chloro-5-[5-[6-[4-[2-[3-chloro-5-[2-(4-pyridin-2-ylphenyl)phenyl]phenyl]phenyl]phenyl]-3-pyridinyl]-2-(4-quinolin-2-ylphenyl)phenyl]phenyl]phenyl]phenyl]quinoline
PubChem CID126638747
Molecular FormulaC88H56Cl2N4
Molecular Weight1240.35 g/mol
Exact Mass1238.39
IUPAC Name2-[4-[2-[3-chloro-5-[5-[6-[4-[2-[3-chloro-5-[2-(4-pyridin-2-ylphenyl)phenyl]phenyl]phenyl]phenyl]-3-pyridinyl]-2-(4-quinolin-2-ylphenyl)phenyl]phenyl]phenyl]phenyl]quinoline
SMILESClc1cc(-c2ccccc2-c2ccc(-c3ccccn3)cc2)cc(-c2ccccc2-c2ccc(-c3ccc(-c4ccc(-c5ccc(-c6ccc7ccccc7n6)cc5)c(-c5cc(Cl)cc(-c6ccccc6-c6ccc(-c7ccc8ccccc8n7)cc6)c5)c4)cn3)cc2)c1
InChIInChI=1S/C88H56Cl2N4/c89-73-51-69(78-18-6-3-15-75(78)57-24-32-63(33-25-57)83-21-11-12-48-91-83)49-70(52-73)79-19-7-4-16-76(79)58-26-34-64(35-27-58)84-45-43-68(56-92-84)67-40-44-81(60-30-38-66(39-31-60)88-47-42-62-14-2-10-23-86(62)94-88)82(55-67)72-50-71(53-74(90)54-72)80-20-8-5-17-77(80)59-28-36-65(37-29-59)87-46-41-61-13-1-9-22-85(61)93-87/h1-56H
InChIKeyBUOLNOBRURBYBE-UHFFFAOYSA-N
XLogP24.55
TPSA51.56 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds13
Heavy Atoms94
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 5001240.35
LogP ≤ 524.55
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Analyze 2-[4-[2-[3-chloro-5-[5-[6-[4-[2-[3-chloro-5-[2-(4-pyridin-2-ylphenyl)phenyl]phenyl]phenyl]phenyl]-3-pyridinyl]-2-(4-quinolin-2-ylphenyl)phenyl]phenyl]phenyl]phenyl]quinoline with MolForge

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Related Compounds

2-phenyl-5-[2-[3-[2-(6-phenyl-3-pyridinyl)phenyl]-5-[2-(4-pyridin-2-ylphenyl)phenyl]phenyl]phenyl]pyridine
CID 122487708
5-[2-[3,5-bis[2-(4-pyridin-2-ylphenyl)phenyl]phenyl]phenyl]-2-[3-(4-phenylphenyl)phenyl]pyridine
CID 153458177
2-[4-[2-[3-chloro-5-[4,5-dimethyl-2-(4-pyridin-2-ylphenyl)phenyl]phenyl]-4,5-dimethylphenyl]phenyl]pyridine
CID 134313361
2-[4-[4-(4-pyridin-2-ylphenyl)-6-(4-quinolin-2-ylphenyl)-1,3,5-triazin-2-yl]phenyl]quinoline
CID 122427220
2-[4-[2-[3,5-bis[2-(4-pyridin-2-ylphenyl)phenyl]phenyl]phenyl]-3-(4-phenylphenyl)phenyl]-3-phenylquinoxaline
CID 153458494
2-[4-[2-[3,5-bis[2-(4-pyridin-2-ylphenyl)phenyl]phenyl]phenyl]-3-phenanthren-2-ylphenyl]-5-methylpyridine
CID 153458455
2-[2-[3,5-bis[2-(4-pyridin-2-ylphenyl)ethyl]phenyl]phenyl]-5-quinolin-2-ylphenol
CID 165149477
3-[3-[2,6-bis(4-phenylphenyl)-4-pyridinyl]-5-isoquinolin-3-ylphenyl]isoquinoline;2-[3-[2,6-bis(3-phenylphenyl)-4-pyridinyl]-5-quinolin-2-ylphenyl]quinoline;3-[3-[2,6-bis(4-pyridin-2-ylphenyl)-4-pyridinyl]-5-isoquinolin-3-ylphenyl]isoquinoline
CID 163983947
2-[4-[2-[3,5-bis[2-(4-pyridin-2-ylphenyl)phenyl]phenyl]-5-phenylphenyl]-3-(4-phenylphenyl)phenyl]-4-phenylpyridine
CID 148872624
2-[4-[2-[3,5-bis[5-fluoro-2-(4-pyridin-2-ylphenyl)phenyl]phenyl]phenyl]-3-(4-phenylphenyl)phenyl]pyridine
CID 153458373
3,5-bis[2-(4-quinolin-2-ylphenyl)phenyl]benzoyl chloride;methane
CID 160911064
2-[2-(4-fluoranthen-2-ylphenyl)phenyl]pyridine;2-[3-(4-fluoranthen-2-ylphenyl)phenyl]pyridine;2-(4-fluoranthen-2-ylphenyl)-5-phenylpyridine;4-[3-(4-fluoranthen-2-ylphenyl)phenyl]pyridine;4-[4-(4-fluoranthen-2-ylphenyl)phenyl]pyridine;5-(4-fluoranthen-2-ylphenyl)-2-phenylpyridine
CID 158843363

Frequently Asked Questions

What is the IUPAC name of 2-[4-[2-[3-chloro-5-[5-[6-[4-[2-[3-chloro-5-[2-(4-pyridin-2-ylphenyl)phenyl]phenyl]phenyl]phenyl]-3-pyridinyl]-2-(4-quinolin-2-ylphenyl)phenyl]phenyl]phenyl]phenyl]quinoline?
The IUPAC name of 2-[4-[2-[3-chloro-5-[5-[6-[4-[2-[3-chloro-5-[2-(4-pyridin-2-ylphenyl)phenyl]phenyl]phenyl]phenyl]-3-pyridinyl]-2-(4-quinolin-2-ylphenyl)phenyl]phenyl]phenyl]phenyl]quinoline (CID 126638747) is 2-[4-[2-[3-chloro-5-[5-[6-[4-[2-[3-chloro-5-[2-(4-pyridin-2-ylphenyl)phenyl]phenyl]phenyl]phenyl]-3-pyridinyl]-2-(4-quinolin-2-ylphenyl)phenyl]phenyl]phenyl]phenyl]quinoline.
What is the SMILES notation for 2-[4-[2-[3-chloro-5-[5-[6-[4-[2-[3-chloro-5-[2-(4-pyridin-2-ylphenyl)phenyl]phenyl]phenyl]phenyl]-3-pyridinyl]-2-(4-quinolin-2-ylphenyl)phenyl]phenyl]phenyl]phenyl]quinoline?
The canonical SMILES for 2-[4-[2-[3-chloro-5-[5-[6-[4-[2-[3-chloro-5-[2-(4-pyridin-2-ylphenyl)phenyl]phenyl]phenyl]phenyl]-3-pyridinyl]-2-(4-quinolin-2-ylphenyl)phenyl]phenyl]phenyl]phenyl]quinoline is Clc1cc(-c2ccccc2-c2ccc(-c3ccccn3)cc2)cc(-c2ccccc2-c2ccc(-c3ccc(-c4ccc(-c5ccc(-c6ccc7ccccc7n6)cc5)c(-c5cc(Cl)cc(-c6ccccc6-c6ccc(-c7ccc8ccccc8n7)cc6)c5)c4)cn3)cc2)c1.
What is the InChIKey of 2-[4-[2-[3-chloro-5-[5-[6-[4-[2-[3-chloro-5-[2-(4-pyridin-2-ylphenyl)phenyl]phenyl]phenyl]phenyl]-3-pyridinyl]-2-(4-quinolin-2-ylphenyl)phenyl]phenyl]phenyl]phenyl]quinoline?
The InChIKey is BUOLNOBRURBYBE-UHFFFAOYSA-N. The full InChI is InChI=1S/C88H56Cl2N4/c89-73-51-69(78-18-6-3-15-75(78)57-24-32-63(33-25-57)83-21-11-12-48-91-83)49-70(52-73)79-19-7-4-16-76(79)58-26-34-64(35-27-58)84-45-43-68(56-92-84)67-40-44-81(60-30-38-66(39-31-60)88-47-42-62-14-2-10-23-86(62)94-88)82(55-67)72-50-71(53-74(90)54-72)80-20-8-5-17-77(80)59-28-36-65(37-29-59)87-46-41-61-13-1-9-22-85(61)93-87/h1-56H.
What are the key properties of 2-[4-[2-[3-chloro-5-[5-[6-[4-[2-[3-chloro-5-[2-(4-pyridin-2-ylphenyl)phenyl]phenyl]phenyl]phenyl]-3-pyridinyl]-2-(4-quinolin-2-ylphenyl)phenyl]phenyl]phenyl]phenyl]quinoline?
2-[4-[2-[3-chloro-5-[5-[6-[4-[2-[3-chloro-5-[2-(4-pyridin-2-ylphenyl)phenyl]phenyl]phenyl]phenyl]-3-pyridinyl]-2-(4-quinolin-2-ylphenyl)phenyl]phenyl]phenyl]phenyl]quinoline has a molecular weight of 1240.35 g/mol, XLogP of 24.55, 13 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[4-[2-[3-chloro-5-[5-[6-[4-[2-[3-chloro-5-[2-(4-pyridin-2-ylphenyl)phenyl]phenyl]phenyl]phenyl]-3-pyridinyl]-2-(4-quinolin-2-ylphenyl)phenyl]phenyl]phenyl]phenyl]quinoline is sourced from PubChem (CID 126638747), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).