2-(4-fluoro-3-phenylmethoxyphenyl)-1-[2-(4-fluoro-3-phenylmethoxyphenyl)naphthalen-1-yl]oxynaphthalene

C46H32F2O3 — CID 142781672

IUPAC2-(4-fluoro-3-phenylmethoxyphenyl)-1-[2-(4-fluoro-3-phenylmethoxyphenyl)naphthalen-1-yl]oxynaphthalene
SMILESFc1ccc(-c2ccc3ccccc3c2Oc2c(-c3ccc(F)c(OCc4ccccc4)c3)ccc3ccccc23)cc1OCc1ccccc1
InChIInChI=1S/C46H32F2O3/c47-41-25-21-35(27-43(41)49-29-31-11-3-1-4-12-31)39-23-19-33-15-7-9-17-37(33)45(39)51-46-38-18-10-8-16-34(38)20-24-40(46)36-22-26-42(48)44(28-36)50-30-32-13-5-2-6-14-32/h1-28H,29-30H2
InChIKeyXBLXHOYJVBVBHZ-UHFFFAOYSA-N
MW670.76 g/mol
LogP12.56
Rot. Bonds10

About 2-(4-fluoro-3-phenylmethoxyphenyl)-1-[2-(4-fluoro-3-phenylmethoxyphenyl)naphthalen-1-yl]oxynaphthalene

2-(4-fluoro-3-phenylmethoxyphenyl)-1-[2-(4-fluoro-3-phenylmethoxyphenyl)naphthalen-1-yl]oxynaphthalene (PubChem CID 142781672) has the molecular formula C46H32F2O3 and a molecular weight of 670.76 g/mol. Its IUPAC name is 2-(4-fluoro-3-phenylmethoxyphenyl)-1-[2-(4-fluoro-3-phenylmethoxyphenyl)naphthalen-1-yl]oxynaphthalene.

Molecular Properties

Compound Name2-(4-fluoro-3-phenylmethoxyphenyl)-1-[2-(4-fluoro-3-phenylmethoxyphenyl)naphthalen-1-yl]oxynaphthalene
PubChem CID142781672
Molecular FormulaC46H32F2O3
Molecular Weight670.76 g/mol
Exact Mass670.23
IUPAC Name2-(4-fluoro-3-phenylmethoxyphenyl)-1-[2-(4-fluoro-3-phenylmethoxyphenyl)naphthalen-1-yl]oxynaphthalene
SMILESFc1ccc(-c2ccc3ccccc3c2Oc2c(-c3ccc(F)c(OCc4ccccc4)c3)ccc3ccccc23)cc1OCc1ccccc1
InChIInChI=1S/C46H32F2O3/c47-41-25-21-35(27-43(41)49-29-31-11-3-1-4-12-31)39-23-19-33-15-7-9-17-37(33)45(39)51-46-38-18-10-8-16-34(38)20-24-40(46)36-22-26-42(48)44(28-36)50-30-32-13-5-2-6-14-32/h1-28H,29-30H2
InChIKeyXBLXHOYJVBVBHZ-UHFFFAOYSA-N
XLogP12.56
TPSA27.69 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds10
Heavy Atoms51
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500670.76
LogP ≤ 512.56
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Analyze 2-(4-fluoro-3-phenylmethoxyphenyl)-1-[2-(4-fluoro-3-phenylmethoxyphenyl)naphthalen-1-yl]oxynaphthalene 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

1,2-bis(phenylmethoxy)naphthalene
CID 67710722
4-(2-fluorophenyl)-2-phenylmethoxyaniline
CID 171921752
7-fluoro-1-phenylmethoxynaphthalene
CID 154464455
4-(4-chloro-2-fluorophenyl)-2-phenylmethoxybenzonitrile
CID 175686449
[4-[5-chloro-2-(2-phenylmethoxynaphthalen-1-yl)phenyl]phenyl]-phenylphosphane
CID 176912346
[5-(4-chloro-2-fluorophenyl)-2-phenylmethoxyphenyl]methanamine
CID 172650028
4-(2,5-difluorophenyl)-2-phenylmethoxybenzonitrile
CID 175686453
4-[4-fluoro-3-(pyridin-4-ylmethoxy)phenyl]-2H-phthalazin-1-one
CID 110187327
methanol;2-phenylmethoxybicyclo[3.1.0]hexa-1,3,5-triene
CID 174530188
2-fluoro-4-(2-phenylmethoxyphenyl)benzoic acid
CID 53228660
2,3,6,7,10,11-hexakis(phenylmethoxy)triphenylene
CID 11040205
5-[4-fluoro-3-(pyridin-4-ylmethoxy)phenyl]-3-phenylpyridazine
CID 10383693

Frequently Asked Questions

What is the IUPAC name of 2-(4-fluoro-3-phenylmethoxyphenyl)-1-[2-(4-fluoro-3-phenylmethoxyphenyl)naphthalen-1-yl]oxynaphthalene?
The IUPAC name of 2-(4-fluoro-3-phenylmethoxyphenyl)-1-[2-(4-fluoro-3-phenylmethoxyphenyl)naphthalen-1-yl]oxynaphthalene (CID 142781672) is 2-(4-fluoro-3-phenylmethoxyphenyl)-1-[2-(4-fluoro-3-phenylmethoxyphenyl)naphthalen-1-yl]oxynaphthalene.
What is the SMILES notation for 2-(4-fluoro-3-phenylmethoxyphenyl)-1-[2-(4-fluoro-3-phenylmethoxyphenyl)naphthalen-1-yl]oxynaphthalene?
The canonical SMILES for 2-(4-fluoro-3-phenylmethoxyphenyl)-1-[2-(4-fluoro-3-phenylmethoxyphenyl)naphthalen-1-yl]oxynaphthalene is Fc1ccc(-c2ccc3ccccc3c2Oc2c(-c3ccc(F)c(OCc4ccccc4)c3)ccc3ccccc23)cc1OCc1ccccc1.
What is the InChIKey of 2-(4-fluoro-3-phenylmethoxyphenyl)-1-[2-(4-fluoro-3-phenylmethoxyphenyl)naphthalen-1-yl]oxynaphthalene?
The InChIKey is XBLXHOYJVBVBHZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C46H32F2O3/c47-41-25-21-35(27-43(41)49-29-31-11-3-1-4-12-31)39-23-19-33-15-7-9-17-37(33)45(39)51-46-38-18-10-8-16-34(38)20-24-40(46)36-22-26-42(48)44(28-36)50-30-32-13-5-2-6-14-32/h1-28H,29-30H2.
What are the key properties of 2-(4-fluoro-3-phenylmethoxyphenyl)-1-[2-(4-fluoro-3-phenylmethoxyphenyl)naphthalen-1-yl]oxynaphthalene?
2-(4-fluoro-3-phenylmethoxyphenyl)-1-[2-(4-fluoro-3-phenylmethoxyphenyl)naphthalen-1-yl]oxynaphthalene has a molecular weight of 670.76 g/mol, XLogP of 12.56, 10 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-fluoro-3-phenylmethoxyphenyl)-1-[2-(4-fluoro-3-phenylmethoxyphenyl)naphthalen-1-yl]oxynaphthalene is sourced from PubChem (CID 142781672), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).