4-[[3,5-bis[[3,5-bis(phenylmethoxy)phenyl]methoxy]phenyl]methoxy]-2-[4-[[3,5-bis[[3,5-bis(phenylmethoxy)phenyl]methoxy]phenyl]methoxy]-2-pyridinyl]pyridine

C108H92N2O14 — CID 102467208

IUPAC4-[[3,5-bis[[3,5-bis(phenylmethoxy)phenyl]methoxy]phenyl]methoxy]-2-[4-[[3,5-bis[[3,5-bis(phenylmethoxy)phenyl]methoxy]phenyl]methoxy]-2-pyridinyl]pyridine
SMILESc1ccc(COc2cc(COc3cc(COc4ccnc(-c5cc(OCc6cc(OCc7cc(OCc8ccccc8)cc(OCc8ccccc8)c7)cc(OCc7cc(OCc8ccccc8)cc(OCc8ccccc8)c7)c6)ccn5)c4)cc(OCc4cc(OCc5ccccc5)cc(OCc5ccccc5)c4)c3)cc(OCc3ccccc3)c2)cc1
InChIInChI=1S/C108H92N2O14/c1-9-25-79(26-10-1)65-113-95-49-89(50-96(57-95)114-66-80-27-11-2-12-28-80)75-121-103-45-87(46-104(61-103)122-76-90-51-97(115-67-81-29-13-3-14-30-81)58-98(52-90)116-68-82-31-15-4-16-32-82)73-111-93-41-43-109-107(63-93)108-64-94(42-44-110-108)112-74-88-47-105(123-77-91-53-99(117-69-83-33-17-5-18-34-83)59-100(54-91)118-70-84-35-19-6-20-36-84)62-106(48-88)124-78-92-55-101(119-71-85-37-21-7-22-38-85)60-102(56-92)120-72-86-39-23-8-24-40-86/h1-64H,65-78H2
InChIKeyQVSZYEKRHKMBCZ-UHFFFAOYSA-N
MW1641.92 g/mol
LogP24.25
Rot. Bonds43

About 4-[[3,5-bis[[3,5-bis(phenylmethoxy)phenyl]methoxy]phenyl]methoxy]-2-[4-[[3,5-bis[[3,5-bis(phenylmethoxy)phenyl]methoxy]phenyl]methoxy]-2-pyridinyl]pyridine

4-[[3,5-bis[[3,5-bis(phenylmethoxy)phenyl]methoxy]phenyl]methoxy]-2-[4-[[3,5-bis[[3,5-bis(phenylmethoxy)phenyl]methoxy]phenyl]methoxy]-2-pyridinyl]pyridine (PubChem CID 102467208) has the molecular formula C108H92N2O14 and a molecular weight of 1641.92 g/mol. Its IUPAC name is 4-[[3,5-bis[[3,5-bis(phenylmethoxy)phenyl]methoxy]phenyl]methoxy]-2-[4-[[3,5-bis[[3,5-bis(phenylmethoxy)phenyl]methoxy]phenyl]methoxy]-2-pyridinyl]pyridine.

Molecular Properties

Compound Name4-[[3,5-bis[[3,5-bis(phenylmethoxy)phenyl]methoxy]phenyl]methoxy]-2-[4-[[3,5-bis[[3,5-bis(phenylmethoxy)phenyl]methoxy]phenyl]methoxy]-2-pyridinyl]pyridine
PubChem CID102467208
Molecular FormulaC108H92N2O14
Molecular Weight1641.92 g/mol
Exact Mass1640.65
IUPAC Name4-[[3,5-bis[[3,5-bis(phenylmethoxy)phenyl]methoxy]phenyl]methoxy]-2-[4-[[3,5-bis[[3,5-bis(phenylmethoxy)phenyl]methoxy]phenyl]methoxy]-2-pyridinyl]pyridine
SMILESc1ccc(COc2cc(COc3cc(COc4ccnc(-c5cc(OCc6cc(OCc7cc(OCc8ccccc8)cc(OCc8ccccc8)c7)cc(OCc7cc(OCc8ccccc8)cc(OCc8ccccc8)c7)c6)ccn5)c4)cc(OCc4cc(OCc5ccccc5)cc(OCc5ccccc5)c4)c3)cc(OCc3ccccc3)c2)cc1
InChIInChI=1S/C108H92N2O14/c1-9-25-79(26-10-1)65-113-95-49-89(50-96(57-95)114-66-80-27-11-2-12-28-80)75-121-103-45-87(46-104(61-103)122-76-90-51-97(115-67-81-29-13-3-14-30-81)58-98(52-90)116-68-82-31-15-4-16-32-82)73-111-93-41-43-109-107(63-93)108-64-94(42-44-110-108)112-74-88-47-105(123-77-91-53-99(117-69-83-33-17-5-18-34-83)59-100(54-91)118-70-84-35-19-6-20-36-84)62-106(48-88)124-78-92-55-101(119-71-85-37-21-7-22-38-85)60-102(56-92)120-72-86-39-23-8-24-40-86/h1-64H,65-78H2
InChIKeyQVSZYEKRHKMBCZ-UHFFFAOYSA-N
XLogP24.25
TPSA155.00 Ų
H-Bond Donors
H-Bond Acceptors16
Rotatable Bonds43
Heavy Atoms124
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5001641.92
LogP ≤ 524.25
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 1016

Analyze 4-[[3,5-bis[[3,5-bis(phenylmethoxy)phenyl]methoxy]phenyl]methoxy]-2-[4-[[3,5-bis[[3,5-bis(phenylmethoxy)phenyl]methoxy]phenyl]methoxy]-2-pyridinyl]pyridine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

[3,5-bis[[3,5-bis(phenylmethoxy)phenyl]methoxy]phenyl]methanol
CID 15385707
1,3-bis[[3,5-bis[[3,5-bis[[3,5-bis(phenylmethoxy)phenyl]methoxy]phenyl]methoxy]phenyl]methoxy]-5-methylbenzene
CID 102395902
[3,5-bis[[3,5-bis[[3,5-bis(phenylmethoxy)phenyl]methoxy]phenyl]methoxy]phenyl]methanamine
CID 101273679
1-iodo-3,5-bis(phenylmethoxy)benzene
CID 15389195
2-ethyl-4-phenylmethoxypyridine
CID 130153338
1,4-bis[[3,5-bis(phenylmethoxy)phenyl]methoxy]-2,5-diiodobenzene
CID 101408465
1,3-bis[[3,5-bis(phenylmethoxy)phenyl]methoxy]-5-(2-methylpropyl)benzene
CID 59422757
1,3-bis[[3,5-bis[[3,5-bis(phenylmethoxy)phenyl]methoxy]phenyl]methyl]-2H-imidazole
CID 101386591
N-[(3-phenylmethoxyphenyl)methyl]pyridin-4-amine
CID 141029302
1,3-bis[[3,5-bis[(3,5-dichlorophenoxy)methyl]phenoxy]methyl]-5-phenylmethoxybenzene
CID 132525104
3-[[3-[[3-[[3-(hydroxymethyl)-5-phenylmethoxyphenoxy]methyl]-5-phenylmethoxyphenoxy]methyl]-5-phenylmethoxyphenoxy]methyl]-5-phenylmethoxyphenol
CID 101175071
1-(4-phenylmethoxy-2-pyridinyl)ethanone
CID 151357228

Frequently Asked Questions

What is the IUPAC name of 4-[[3,5-bis[[3,5-bis(phenylmethoxy)phenyl]methoxy]phenyl]methoxy]-2-[4-[[3,5-bis[[3,5-bis(phenylmethoxy)phenyl]methoxy]phenyl]methoxy]-2-pyridinyl]pyridine?
The IUPAC name of 4-[[3,5-bis[[3,5-bis(phenylmethoxy)phenyl]methoxy]phenyl]methoxy]-2-[4-[[3,5-bis[[3,5-bis(phenylmethoxy)phenyl]methoxy]phenyl]methoxy]-2-pyridinyl]pyridine (CID 102467208) is 4-[[3,5-bis[[3,5-bis(phenylmethoxy)phenyl]methoxy]phenyl]methoxy]-2-[4-[[3,5-bis[[3,5-bis(phenylmethoxy)phenyl]methoxy]phenyl]methoxy]-2-pyridinyl]pyridine.
What is the SMILES notation for 4-[[3,5-bis[[3,5-bis(phenylmethoxy)phenyl]methoxy]phenyl]methoxy]-2-[4-[[3,5-bis[[3,5-bis(phenylmethoxy)phenyl]methoxy]phenyl]methoxy]-2-pyridinyl]pyridine?
The canonical SMILES for 4-[[3,5-bis[[3,5-bis(phenylmethoxy)phenyl]methoxy]phenyl]methoxy]-2-[4-[[3,5-bis[[3,5-bis(phenylmethoxy)phenyl]methoxy]phenyl]methoxy]-2-pyridinyl]pyridine is c1ccc(COc2cc(COc3cc(COc4ccnc(-c5cc(OCc6cc(OCc7cc(OCc8ccccc8)cc(OCc8ccccc8)c7)cc(OCc7cc(OCc8ccccc8)cc(OCc8ccccc8)c7)c6)ccn5)c4)cc(OCc4cc(OCc5ccccc5)cc(OCc5ccccc5)c4)c3)cc(OCc3ccccc3)c2)cc1.
What is the InChIKey of 4-[[3,5-bis[[3,5-bis(phenylmethoxy)phenyl]methoxy]phenyl]methoxy]-2-[4-[[3,5-bis[[3,5-bis(phenylmethoxy)phenyl]methoxy]phenyl]methoxy]-2-pyridinyl]pyridine?
The InChIKey is QVSZYEKRHKMBCZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C108H92N2O14/c1-9-25-79(26-10-1)65-113-95-49-89(50-96(57-95)114-66-80-27-11-2-12-28-80)75-121-103-45-87(46-104(61-103)122-76-90-51-97(115-67-81-29-13-3-14-30-81)58-98(52-90)116-68-82-31-15-4-16-32-82)73-111-93-41-43-109-107(63-93)108-64-94(42-44-110-108)112-74-88-47-105(123-77-91-53-99(117-69-83-33-17-5-18-34-83)59-100(54-91)118-70-84-35-19-6-20-36-84)62-106(48-88)124-78-92-55-101(119-71-85-37-21-7-22-38-85)60-102(56-92)120-72-86-39-23-8-24-40-86/h1-64H,65-78H2.
What are the key properties of 4-[[3,5-bis[[3,5-bis(phenylmethoxy)phenyl]methoxy]phenyl]methoxy]-2-[4-[[3,5-bis[[3,5-bis(phenylmethoxy)phenyl]methoxy]phenyl]methoxy]-2-pyridinyl]pyridine?
4-[[3,5-bis[[3,5-bis(phenylmethoxy)phenyl]methoxy]phenyl]methoxy]-2-[4-[[3,5-bis[[3,5-bis(phenylmethoxy)phenyl]methoxy]phenyl]methoxy]-2-pyridinyl]pyridine has a molecular weight of 1641.92 g/mol, XLogP of 24.25, 43 rotatable bonds, 0 hydrogen bond donors, and 16 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[[3,5-bis[[3,5-bis(phenylmethoxy)phenyl]methoxy]phenyl]methoxy]-2-[4-[[3,5-bis[[3,5-bis(phenylmethoxy)phenyl]methoxy]phenyl]methoxy]-2-pyridinyl]pyridine is sourced from PubChem (CID 102467208), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).