1-[1,3-bis(4-methoxyphenyl)-2-[(4-methoxyphenyl)methyl]propan-2-yl]-4-methoxybenzene

C32H34O4 — CID 71248389

IUPAC1-[1,3-bis(4-methoxyphenyl)-2-[(4-methoxyphenyl)methyl]propan-2-yl]-4-methoxybenzene
SMILESCOc1ccc(CC(Cc2ccc(OC)cc2)(Cc2ccc(OC)cc2)c2ccc(OC)cc2)cc1
InChIInChI=1S/C32H34O4/c1-33-28-13-5-24(6-14-28)21-32(27-11-19-31(36-4)20-12-27,22-25-7-15-29(34-2)16-8-25)23-26-9-17-30(35-3)18-10-26/h5-20H,21-23H2,1-4H3
InChIKeyGETPDNAYNYRXEU-UHFFFAOYSA-N
MW482.62 g/mol
LogP6.69
Rot. Bonds11

About 1-[1,3-bis(4-methoxyphenyl)-2-[(4-methoxyphenyl)methyl]propan-2-yl]-4-methoxybenzene

1-[1,3-bis(4-methoxyphenyl)-2-[(4-methoxyphenyl)methyl]propan-2-yl]-4-methoxybenzene (PubChem CID 71248389) has the molecular formula C32H34O4 and a molecular weight of 482.62 g/mol. Its IUPAC name is 1-[1,3-bis(4-methoxyphenyl)-2-[(4-methoxyphenyl)methyl]propan-2-yl]-4-methoxybenzene.

Molecular Properties

Compound Name1-[1,3-bis(4-methoxyphenyl)-2-[(4-methoxyphenyl)methyl]propan-2-yl]-4-methoxybenzene
PubChem CID71248389
Molecular FormulaC32H34O4
Molecular Weight482.62 g/mol
Exact Mass482.25
IUPAC Name1-[1,3-bis(4-methoxyphenyl)-2-[(4-methoxyphenyl)methyl]propan-2-yl]-4-methoxybenzene
SMILESCOc1ccc(CC(Cc2ccc(OC)cc2)(Cc2ccc(OC)cc2)c2ccc(OC)cc2)cc1
InChIInChI=1S/C32H34O4/c1-33-28-13-5-24(6-14-28)21-32(27-11-19-31(36-4)20-12-27,22-25-7-15-29(34-2)16-8-25)23-26-9-17-30(35-3)18-10-26/h5-20H,21-23H2,1-4H3
InChIKeyGETPDNAYNYRXEU-UHFFFAOYSA-N
XLogP6.69
TPSA36.92 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds11
Heavy Atoms36
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500482.62
LogP ≤ 56.69
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

1,2-bis(4-methoxyphenyl)propan-2-amine
CID 63273092
(2R)-2,3-bis(4-methoxyphenyl)-2-methylpropanenitrile
CID 129389679
2-(hydroxymethyl)-2-(4-methoxyphenyl)propane-1,3-diol
CID 175668445
2-(4-methoxyphenyl)-1-(4-methylphenyl)propan-2-ol
CID 60798775
2,2-difluoro-3-(4-methoxyphenyl)propanal
CID 54572596
2-amino-3-(4-methoxyphenyl)-2-methylpropanenitrile
CID 14989929
1-methoxy-4-[1,1,3-tris(4-methoxyphenyl)propyl]benzene
CID 22900338
2-(4-ethoxyphenyl)-1-(4-methoxyphenyl)propan-2-amine
CID 63273223
1-(2,2-dimethylpropyl)-4-[1-(4-methoxyphenyl)-2,2-dimethyl-1-phenylpropyl]benzene
CID 135291592
1-methoxy-4-(2,2,3,3-tetrafluoropropyl)benzene
CID 132937165
(2R)-2-(4-chlorophenyl)-3-(4-methoxyphenyl)-2-methylpropanal
CID 42177102
3-hydroxy-4-(4-methoxyphenyl)-2,2,3-trimethylbutanenitrile
CID 79129241

Frequently Asked Questions

What is the IUPAC name of 1-[1,3-bis(4-methoxyphenyl)-2-[(4-methoxyphenyl)methyl]propan-2-yl]-4-methoxybenzene?
The IUPAC name of 1-[1,3-bis(4-methoxyphenyl)-2-[(4-methoxyphenyl)methyl]propan-2-yl]-4-methoxybenzene (CID 71248389) is 1-[1,3-bis(4-methoxyphenyl)-2-[(4-methoxyphenyl)methyl]propan-2-yl]-4-methoxybenzene.
What is the SMILES notation for 1-[1,3-bis(4-methoxyphenyl)-2-[(4-methoxyphenyl)methyl]propan-2-yl]-4-methoxybenzene?
The canonical SMILES for 1-[1,3-bis(4-methoxyphenyl)-2-[(4-methoxyphenyl)methyl]propan-2-yl]-4-methoxybenzene is COc1ccc(CC(Cc2ccc(OC)cc2)(Cc2ccc(OC)cc2)c2ccc(OC)cc2)cc1.
What is the InChIKey of 1-[1,3-bis(4-methoxyphenyl)-2-[(4-methoxyphenyl)methyl]propan-2-yl]-4-methoxybenzene?
The InChIKey is GETPDNAYNYRXEU-UHFFFAOYSA-N. The full InChI is InChI=1S/C32H34O4/c1-33-28-13-5-24(6-14-28)21-32(27-11-19-31(36-4)20-12-27,22-25-7-15-29(34-2)16-8-25)23-26-9-17-30(35-3)18-10-26/h5-20H,21-23H2,1-4H3.
What are the key properties of 1-[1,3-bis(4-methoxyphenyl)-2-[(4-methoxyphenyl)methyl]propan-2-yl]-4-methoxybenzene?
1-[1,3-bis(4-methoxyphenyl)-2-[(4-methoxyphenyl)methyl]propan-2-yl]-4-methoxybenzene has a molecular weight of 482.62 g/mol, XLogP of 6.69, 11 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[1,3-bis(4-methoxyphenyl)-2-[(4-methoxyphenyl)methyl]propan-2-yl]-4-methoxybenzene is sourced from PubChem (CID 71248389), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).