3,4-dimethoxy-2-(4-methoxyphenyl)-5-phenylphenol

C21H20O4 — CID 139590135

IUPAC3,4-dimethoxy-2-(4-methoxyphenyl)-5-phenylphenol
SMILESCOc1ccc(-c2c(O)cc(-c3ccccc3)c(OC)c2OC)cc1
InChIInChI=1S/C21H20O4/c1-23-16-11-9-15(10-12-16)19-18(22)13-17(14-7-5-4-6-8-14)20(24-2)21(19)25-3/h4-13,22H,1-3H3
InChIKeyCTOCZSBIIZIHFB-UHFFFAOYSA-N
MW336.39 g/mol
LogP4.75
Rot. Bonds5

About 3,4-dimethoxy-2-(4-methoxyphenyl)-5-phenylphenol

3,4-dimethoxy-2-(4-methoxyphenyl)-5-phenylphenol (PubChem CID 139590135) has the molecular formula C21H20O4 and a molecular weight of 336.39 g/mol. Its IUPAC name is 3,4-dimethoxy-2-(4-methoxyphenyl)-5-phenylphenol.

Molecular Properties

Compound Name3,4-dimethoxy-2-(4-methoxyphenyl)-5-phenylphenol
PubChem CID139590135
Molecular FormulaC21H20O4
Molecular Weight336.39 g/mol
Exact Mass336.14
IUPAC Name3,4-dimethoxy-2-(4-methoxyphenyl)-5-phenylphenol
SMILESCOc1ccc(-c2c(O)cc(-c3ccccc3)c(OC)c2OC)cc1
InChIInChI=1S/C21H20O4/c1-23-16-11-9-15(10-12-16)19-18(22)13-17(14-7-5-4-6-8-14)20(24-2)21(19)25-3/h4-13,22H,1-3H3
InChIKeyCTOCZSBIIZIHFB-UHFFFAOYSA-N
XLogP4.75
TPSA47.92 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500336.39
LogP ≤ 54.75
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

4-methoxy-2,5-diphenylbenzene-1,3-diol
CID 53244203
7-methoxy-3,4-diphenylnaphthalen-2-ol
CID 170563506
[2,5-dihydroxy-3,6-bis(4-methoxyphenyl)phenyl] acetate
CID 10894199
1-[4-(4-methoxyphenyl)phenyl]-2,4,6-triphenyl-3,5-bis(4-phenylphenyl)benzene
CID 138981847
2,5-bis(4-hydroxyphenyl)-4-methoxybenzene-1,3-diol
CID 53262748
5-methoxy-2-(4-methoxyphenyl)phenol
CID 10933283
1-methoxy-4-phenylbenzene;4-(4-methoxyphenyl)phenol
CID 69347648
1-[(E)-2-iodo-1-phenylethenyl]-4-(4-methoxyphenyl)naphthalen-2-ol
CID 132502192
4-(4-methoxyphenyl)-2-phenylquinoline
CID 12523263
3,4-bis(4-methoxyphenyl)-6-phenylbenzene-1,2-diamine
CID 87111772
1-[4-(4-methoxyphenyl)phenyl]-3,5-diphenylbenzene
CID 176774050
2-(4-methoxyphenyl)-1,4-diphenylbenzene
CID 132547745

Frequently Asked Questions

What is the IUPAC name of 3,4-dimethoxy-2-(4-methoxyphenyl)-5-phenylphenol?
The IUPAC name of 3,4-dimethoxy-2-(4-methoxyphenyl)-5-phenylphenol (CID 139590135) is 3,4-dimethoxy-2-(4-methoxyphenyl)-5-phenylphenol.
What is the SMILES notation for 3,4-dimethoxy-2-(4-methoxyphenyl)-5-phenylphenol?
The canonical SMILES for 3,4-dimethoxy-2-(4-methoxyphenyl)-5-phenylphenol is COc1ccc(-c2c(O)cc(-c3ccccc3)c(OC)c2OC)cc1.
What is the InChIKey of 3,4-dimethoxy-2-(4-methoxyphenyl)-5-phenylphenol?
The InChIKey is CTOCZSBIIZIHFB-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H20O4/c1-23-16-11-9-15(10-12-16)19-18(22)13-17(14-7-5-4-6-8-14)20(24-2)21(19)25-3/h4-13,22H,1-3H3.
What are the key properties of 3,4-dimethoxy-2-(4-methoxyphenyl)-5-phenylphenol?
3,4-dimethoxy-2-(4-methoxyphenyl)-5-phenylphenol has a molecular weight of 336.39 g/mol, XLogP of 4.75, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3,4-dimethoxy-2-(4-methoxyphenyl)-5-phenylphenol is sourced from PubChem (CID 139590135), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).