8-[2-[3-[2-[6-[5-[2-[3,5-bis[2-(2-methylimidazo[2,1-a]isoquinolin-8-yl)phenyl]phenyl]phenyl]-2-pyridinyl]-3-pyridinyl]phenyl]-5-[2-(2-methylimidazo[2,1-a]isoquinolin-8-yl)phenyl]phenyl]phenyl]-2-methylimidazo[2,1-a]isoquinoline

C106H72N10 — CID 134434278

IUPAC8-[2-[3-[2-[6-[5-[2-[3,5-bis[2-(2-methylimidazo[2,1-a]isoquinolin-8-yl)phenyl]phenyl]phenyl]-2-pyridinyl]-3-pyridinyl]phenyl]-5-[2-(2-methylimidazo[2,1-a]isoquinolin-8-yl)phenyl]phenyl]phenyl]-2-methylimidazo[2,1-a]isoquinoline
SMILESCc1cn2ccc3cc(-c4ccccc4-c4cc(-c5ccccc5-c5ccc(-c6ccc(-c7ccccc7-c7cc(-c8ccccc8-c8ccc9c(ccn%10cc(C)nc9%10)c8)cc(-c8ccccc8-c8ccc9c(ccn%10cc(C)nc9%10)c8)c7)cn6)nc5)cc(-c5ccccc5-c5ccc6c(ccn7cc(C)nc67)c5)c4)ccc3c2n1
InChIInChI=1S/C106H72N10/c1-65-61-113-45-41-73-49-69(29-35-97(73)103(113)109-65)85-17-5-11-23-91(85)79-53-80(92-24-12-6-18-86(92)70-30-36-98-74(50-70)42-46-114-62-66(2)110-104(98)114)56-83(55-79)95-27-15-9-21-89(95)77-33-39-101(107-59-77)102-40-34-78(60-108-102)90-22-10-16-28-96(90)84-57-81(93-25-13-7-19-87(93)71-31-37-99-75(51-71)43-47-115-63-67(3)111-105(99)115)54-82(58-84)94-26-14-8-20-88(94)72-32-38-100-76(52-72)44-48-116-64-68(4)112-106(100)116/h5-64H,1-4H3
InChIKeyUEPBWQDTHFZJHO-UHFFFAOYSA-N
MW1485.81 g/mol
LogP26.58
Rot. Bonds13

About 8-[2-[3-[2-[6-[5-[2-[3,5-bis[2-(2-methylimidazo[2,1-a]isoquinolin-8-yl)phenyl]phenyl]phenyl]-2-pyridinyl]-3-pyridinyl]phenyl]-5-[2-(2-methylimidazo[2,1-a]isoquinolin-8-yl)phenyl]phenyl]phenyl]-2-methylimidazo[2,1-a]isoquinoline

8-[2-[3-[2-[6-[5-[2-[3,5-bis[2-(2-methylimidazo[2,1-a]isoquinolin-8-yl)phenyl]phenyl]phenyl]-2-pyridinyl]-3-pyridinyl]phenyl]-5-[2-(2-methylimidazo[2,1-a]isoquinolin-8-yl)phenyl]phenyl]phenyl]-2-methylimidazo[2,1-a]isoquinoline (PubChem CID 134434278) has the molecular formula C106H72N10 and a molecular weight of 1485.81 g/mol. Its IUPAC name is 8-[2-[3-[2-[6-[5-[2-[3,5-bis[2-(2-methylimidazo[2,1-a]isoquinolin-8-yl)phenyl]phenyl]phenyl]-2-pyridinyl]-3-pyridinyl]phenyl]-5-[2-(2-methylimidazo[2,1-a]isoquinolin-8-yl)phenyl]phenyl]phenyl]-2-methylimidazo[2,1-a]isoquinoline.

Molecular Properties

Compound Name8-[2-[3-[2-[6-[5-[2-[3,5-bis[2-(2-methylimidazo[2,1-a]isoquinolin-8-yl)phenyl]phenyl]phenyl]-2-pyridinyl]-3-pyridinyl]phenyl]-5-[2-(2-methylimidazo[2,1-a]isoquinolin-8-yl)phenyl]phenyl]phenyl]-2-methylimidazo[2,1-a]isoquinoline
PubChem CID134434278
Molecular FormulaC106H72N10
Molecular Weight1485.81 g/mol
Exact Mass1484.59
IUPAC Name8-[2-[3-[2-[6-[5-[2-[3,5-bis[2-(2-methylimidazo[2,1-a]isoquinolin-8-yl)phenyl]phenyl]phenyl]-2-pyridinyl]-3-pyridinyl]phenyl]-5-[2-(2-methylimidazo[2,1-a]isoquinolin-8-yl)phenyl]phenyl]phenyl]-2-methylimidazo[2,1-a]isoquinoline
SMILESCc1cn2ccc3cc(-c4ccccc4-c4cc(-c5ccccc5-c5ccc(-c6ccc(-c7ccccc7-c7cc(-c8ccccc8-c8ccc9c(ccn%10cc(C)nc9%10)c8)cc(-c8ccccc8-c8ccc9c(ccn%10cc(C)nc9%10)c8)c7)cn6)nc5)cc(-c5ccccc5-c5ccc6c(ccn7cc(C)nc67)c5)c4)ccc3c2n1
InChIInChI=1S/C106H72N10/c1-65-61-113-45-41-73-49-69(29-35-97(73)103(113)109-65)85-17-5-11-23-91(85)79-53-80(92-24-12-6-18-86(92)70-30-36-98-74(50-70)42-46-114-62-66(2)110-104(98)114)56-83(55-79)95-27-15-9-21-89(95)77-33-39-101(107-59-77)102-40-34-78(60-108-102)90-22-10-16-28-96(90)84-57-81(93-25-13-7-19-87(93)71-31-37-99-75(51-71)43-47-115-63-67(3)111-105(99)115)54-82(58-84)94-26-14-8-20-88(94)72-32-38-100-76(52-72)44-48-116-64-68(4)112-106(100)116/h5-64H,1-4H3
InChIKeyUEPBWQDTHFZJHO-UHFFFAOYSA-N
XLogP26.58
TPSA94.98 Ų
H-Bond Donors
H-Bond Acceptors10
Rotatable Bonds13
Heavy Atoms116
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 5001485.81
LogP ≤ 526.58
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 1010

Analyze 8-[2-[3-[2-[6-[5-[2-[3,5-bis[2-(2-methylimidazo[2,1-a]isoquinolin-8-yl)phenyl]phenyl]phenyl]-2-pyridinyl]-3-pyridinyl]phenyl]-5-[2-(2-methylimidazo[2,1-a]isoquinolin-8-yl)phenyl]phenyl]phenyl]-2-methylimidazo[2,1-a]isoquinoline with MolForge

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Launch Full Analysis

Related Compounds

2-(4-Methylphenyl)-3-(piperidin-1-ylmethyl)imidazo[2,1-a]isoquinoline
CID 16188807
7,12-Bis(4-benzylpiperazin-1-yl)-2,8,13-triazatricyclo[7.4.0.02,6]trideca-1(9),3,5,7,10,12-hexaene
CID 10553922
2-((4-(2-(4-Tert-butylphenyl)imidazo[1,2-a]pyridin-8-yl)piperazin-1-yl)methyl)quinoxaline
CID 15602808
2-Methyl-4-[7-[6-(4-propan-2-ylpiperazin-1-yl)-3-pyridinyl]imidazo[1,2-a]pyridin-3-yl]quinoline
CID 139326708
7-Methyl-6-[1-(5-quinolin-3-ylimidazo[4,5-b]pyrazin-3-yl)ethyl]quinoline
CID 86566631
US11459329, Example 52
CID 151835103
US11840546, Example 3
CID 162389384
US11840546, Example 2
CID 162389388
3-Benzyl-2-(4-methylphenyl)imidazo[2,1-a]isoquinoline
CID 46902777
2-(4-Methylphenyl)-3-[(4-methylphenyl)methyl]imidazo[2,1-a]isoquinoline
CID 46902778
2-Cyclohexyl-3-[(4-methylphenyl)methyl]imidazo[2,1-a]isoquinoline
CID 51359026
3-[(4-Methylphenyl)methyl]-2-phenylimidazo[2,1-a]isoquinoline
CID 53299419

Frequently Asked Questions

What is the IUPAC name of 8-[2-[3-[2-[6-[5-[2-[3,5-bis[2-(2-methylimidazo[2,1-a]isoquinolin-8-yl)phenyl]phenyl]phenyl]-2-pyridinyl]-3-pyridinyl]phenyl]-5-[2-(2-methylimidazo[2,1-a]isoquinolin-8-yl)phenyl]phenyl]phenyl]-2-methylimidazo[2,1-a]isoquinoline?
The IUPAC name of 8-[2-[3-[2-[6-[5-[2-[3,5-bis[2-(2-methylimidazo[2,1-a]isoquinolin-8-yl)phenyl]phenyl]phenyl]-2-pyridinyl]-3-pyridinyl]phenyl]-5-[2-(2-methylimidazo[2,1-a]isoquinolin-8-yl)phenyl]phenyl]phenyl]-2-methylimidazo[2,1-a]isoquinoline (CID 134434278) is 8-[2-[3-[2-[6-[5-[2-[3,5-bis[2-(2-methylimidazo[2,1-a]isoquinolin-8-yl)phenyl]phenyl]phenyl]-2-pyridinyl]-3-pyridinyl]phenyl]-5-[2-(2-methylimidazo[2,1-a]isoquinolin-8-yl)phenyl]phenyl]phenyl]-2-methylimidazo[2,1-a]isoquinoline.
What is the SMILES notation for 8-[2-[3-[2-[6-[5-[2-[3,5-bis[2-(2-methylimidazo[2,1-a]isoquinolin-8-yl)phenyl]phenyl]phenyl]-2-pyridinyl]-3-pyridinyl]phenyl]-5-[2-(2-methylimidazo[2,1-a]isoquinolin-8-yl)phenyl]phenyl]phenyl]-2-methylimidazo[2,1-a]isoquinoline?
The canonical SMILES for 8-[2-[3-[2-[6-[5-[2-[3,5-bis[2-(2-methylimidazo[2,1-a]isoquinolin-8-yl)phenyl]phenyl]phenyl]-2-pyridinyl]-3-pyridinyl]phenyl]-5-[2-(2-methylimidazo[2,1-a]isoquinolin-8-yl)phenyl]phenyl]phenyl]-2-methylimidazo[2,1-a]isoquinoline is Cc1cn2ccc3cc(-c4ccccc4-c4cc(-c5ccccc5-c5ccc(-c6ccc(-c7ccccc7-c7cc(-c8ccccc8-c8ccc9c(ccn%10cc(C)nc9%10)c8)cc(-c8ccccc8-c8ccc9c(ccn%10cc(C)nc9%10)c8)c7)cn6)nc5)cc(-c5ccccc5-c5ccc6c(ccn7cc(C)nc67)c5)c4)ccc3c2n1.
What is the InChIKey of 8-[2-[3-[2-[6-[5-[2-[3,5-bis[2-(2-methylimidazo[2,1-a]isoquinolin-8-yl)phenyl]phenyl]phenyl]-2-pyridinyl]-3-pyridinyl]phenyl]-5-[2-(2-methylimidazo[2,1-a]isoquinolin-8-yl)phenyl]phenyl]phenyl]-2-methylimidazo[2,1-a]isoquinoline?
The InChIKey is UEPBWQDTHFZJHO-UHFFFAOYSA-N. The full InChI is InChI=1S/C106H72N10/c1-65-61-113-45-41-73-49-69(29-35-97(73)103(113)109-65)85-17-5-11-23-91(85)79-53-80(92-24-12-6-18-86(92)70-30-36-98-74(50-70)42-46-114-62-66(2)110-104(98)114)56-83(55-79)95-27-15-9-21-89(95)77-33-39-101(107-59-77)102-40-34-78(60-108-102)90-22-10-16-28-96(90)84-57-81(93-25-13-7-19-87(93)71-31-37-99-75(51-71)43-47-115-63-67(3)111-105(99)115)54-82(58-84)94-26-14-8-20-88(94)72-32-38-100-76(52-72)44-48-116-64-68(4)112-106(100)116/h5-64H,1-4H3.
What are the key properties of 8-[2-[3-[2-[6-[5-[2-[3,5-bis[2-(2-methylimidazo[2,1-a]isoquinolin-8-yl)phenyl]phenyl]phenyl]-2-pyridinyl]-3-pyridinyl]phenyl]-5-[2-(2-methylimidazo[2,1-a]isoquinolin-8-yl)phenyl]phenyl]phenyl]-2-methylimidazo[2,1-a]isoquinoline?
8-[2-[3-[2-[6-[5-[2-[3,5-bis[2-(2-methylimidazo[2,1-a]isoquinolin-8-yl)phenyl]phenyl]phenyl]-2-pyridinyl]-3-pyridinyl]phenyl]-5-[2-(2-methylimidazo[2,1-a]isoquinolin-8-yl)phenyl]phenyl]phenyl]-2-methylimidazo[2,1-a]isoquinoline has a molecular weight of 1485.81 g/mol, XLogP of 26.58, 13 rotatable bonds, 0 hydrogen bond donors, and 10 hydrogen bond acceptors.
Where does this data come from?
All data for 8-[2-[3-[2-[6-[5-[2-[3,5-bis[2-(2-methylimidazo[2,1-a]isoquinolin-8-yl)phenyl]phenyl]phenyl]-2-pyridinyl]-3-pyridinyl]phenyl]-5-[2-(2-methylimidazo[2,1-a]isoquinolin-8-yl)phenyl]phenyl]phenyl]-2-methylimidazo[2,1-a]isoquinoline is sourced from PubChem (CID 134434278), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).