1-(methoxymethyl)-4-[[4-(methoxymethyl)-3-methylphenyl]-diphenylmethyl]-2-methylbenzene;2-(methoxymethyl)-6-[[6-(methoxymethyl)naphthalen-2-yl]-diphenylmethyl]naphthalene;2-(methoxymethyl)-1-[2-(methoxymethyl)naphthalen-1-yl]naphthalene;1-(methoxymethyl)-4-[[4-(methoxymethyl)phenyl]-diphenylmethyl]benzene

C121H114O8 — CID 163623788

IUPAC1-(methoxymethyl)-4-[[4-(methoxymethyl)-3-methylphenyl]-diphenylmethyl]-2-methylbenzene;2-(methoxymethyl)-6-[[6-(methoxymethyl)naphthalen-2-yl]-diphenylmethyl]naphthalene;2-(methoxymethyl)-1-[2-(methoxymethyl)naphthalen-1-yl]naphthalene;1-(methoxymethyl)-4-[[4-(methoxymethyl)phenyl]-diphenylmethyl]benzene
SMILESCOCc1ccc(C(c2ccccc2)(c2ccccc2)c2ccc(COC)c(C)c2)cc1C.COCc1ccc(C(c2ccccc2)(c2ccccc2)c2ccc(COC)cc2)cc1.COCc1ccc2cc(C(c3ccccc3)(c3ccccc3)c3ccc4cc(COC)ccc4c3)ccc2c1.COCc1ccc2ccccc2c1-c1c(COC)ccc2ccccc12
InChIInChI=1S/C37H32O2.C31H32O2.C29H28O2.C24H22O2/c1-38-25-27-13-15-31-23-35(19-17-29(31)21-27)37(33-9-5-3-6-10-33,34-11-7-4-8-12-34)36-20-18-30-22-28(26-39-2)14-16-32(30)24-36;1-23-19-29(17-15-25(23)21-32-3)31(27-11-7-5-8-12-27,28-13-9-6-10-14-28)30-18-16-26(22-33-4)24(2)20-30;1-30-21-23-13-17-27(18-14-23)29(25-9-5-3-6-10-25,26-11-7-4-8-12-26)28-19-15-24(16-20-28)22-31-2;1-25-15-19-13-11-17-7-3-5-9-21(17)23(19)24-20(16-26-2)14-12-18-8-4-6-10-22(18)24/h3-24H,25-26H2,1-2H3;5-20H,21-22H2,1-4H3;3-20H,21-22H2,1-2H3;3-14H,15-16H2,1-2H3
InChIKeyHQJFQYJIRLLKGD-UHFFFAOYSA-N
MW1696.23 g/mol
LogP27.96
Rot. Bonds29

About 1-(methoxymethyl)-4-[[4-(methoxymethyl)-3-methylphenyl]-diphenylmethyl]-2-methylbenzene;2-(methoxymethyl)-6-[[6-(methoxymethyl)naphthalen-2-yl]-diphenylmethyl]naphthalene;2-(methoxymethyl)-1-[2-(methoxymethyl)naphthalen-1-yl]naphthalene;1-(methoxymethyl)-4-[[4-(methoxymethyl)phenyl]-diphenylmethyl]benzene

1-(methoxymethyl)-4-[[4-(methoxymethyl)-3-methylphenyl]-diphenylmethyl]-2-methylbenzene;2-(methoxymethyl)-6-[[6-(methoxymethyl)naphthalen-2-yl]-diphenylmethyl]naphthalene;2-(methoxymethyl)-1-[2-(methoxymethyl)naphthalen-1-yl]naphthalene;1-(methoxymethyl)-4-[[4-(methoxymethyl)phenyl]-diphenylmethyl]benzene (PubChem CID 163623788) has the molecular formula C121H114O8 and a molecular weight of 1696.23 g/mol. Its IUPAC name is 1-(methoxymethyl)-4-[[4-(methoxymethyl)-3-methylphenyl]-diphenylmethyl]-2-methylbenzene;2-(methoxymethyl)-6-[[6-(methoxymethyl)naphthalen-2-yl]-diphenylmethyl]naphthalene;2-(methoxymethyl)-1-[2-(methoxymethyl)naphthalen-1-yl]naphthalene;1-(methoxymethyl)-4-[[4-(methoxymethyl)phenyl]-diphenylmethyl]benzene.

Molecular Properties

Compound Name1-(methoxymethyl)-4-[[4-(methoxymethyl)-3-methylphenyl]-diphenylmethyl]-2-methylbenzene;2-(methoxymethyl)-6-[[6-(methoxymethyl)naphthalen-2-yl]-diphenylmethyl]naphthalene;2-(methoxymethyl)-1-[2-(methoxymethyl)naphthalen-1-yl]naphthalene;1-(methoxymethyl)-4-[[4-(methoxymethyl)phenyl]-diphenylmethyl]benzene
PubChem CID163623788
Molecular FormulaC121H114O8
Molecular Weight1696.23 g/mol
Exact Mass1694.85
IUPAC Name1-(methoxymethyl)-4-[[4-(methoxymethyl)-3-methylphenyl]-diphenylmethyl]-2-methylbenzene;2-(methoxymethyl)-6-[[6-(methoxymethyl)naphthalen-2-yl]-diphenylmethyl]naphthalene;2-(methoxymethyl)-1-[2-(methoxymethyl)naphthalen-1-yl]naphthalene;1-(methoxymethyl)-4-[[4-(methoxymethyl)phenyl]-diphenylmethyl]benzene
SMILESCOCc1ccc(C(c2ccccc2)(c2ccccc2)c2ccc(COC)c(C)c2)cc1C.COCc1ccc(C(c2ccccc2)(c2ccccc2)c2ccc(COC)cc2)cc1.COCc1ccc2cc(C(c3ccccc3)(c3ccccc3)c3ccc4cc(COC)ccc4c3)ccc2c1.COCc1ccc2ccccc2c1-c1c(COC)ccc2ccccc12
InChIInChI=1S/C37H32O2.C31H32O2.C29H28O2.C24H22O2/c1-38-25-27-13-15-31-23-35(19-17-29(31)21-27)37(33-9-5-3-6-10-33,34-11-7-4-8-12-34)36-20-18-30-22-28(26-39-2)14-16-32(30)24-36;1-23-19-29(17-15-25(23)21-32-3)31(27-11-7-5-8-12-27,28-13-9-6-10-14-28)30-18-16-26(22-33-4)24(2)20-30;1-30-21-23-13-17-27(18-14-23)29(25-9-5-3-6-10-25,26-11-7-4-8-12-26)28-19-15-24(16-20-28)22-31-2;1-25-15-19-13-11-17-7-3-5-9-21(17)23(19)24-20(16-26-2)14-12-18-8-4-6-10-22(18)24/h3-24H,25-26H2,1-2H3;5-20H,21-22H2,1-4H3;3-20H,21-22H2,1-2H3;3-14H,15-16H2,1-2H3
InChIKeyHQJFQYJIRLLKGD-UHFFFAOYSA-N
XLogP27.96
TPSA73.84 Ų
H-Bond Donors
H-Bond Acceptors8
Rotatable Bonds29
Heavy Atoms129
Complexity

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 5001696.23
LogP ≤ 527.96
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 108

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'triphenyl_methyl-silyl', 'substructure': 'N/A'}

Analyze 1-(methoxymethyl)-4-[[4-(methoxymethyl)-3-methylphenyl]-diphenylmethyl]-2-methylbenzene;2-(methoxymethyl)-6-[[6-(methoxymethyl)naphthalen-2-yl]-diphenylmethyl]naphthalene;2-(methoxymethyl)-1-[2-(methoxymethyl)naphthalen-1-yl]naphthalene;1-(methoxymethyl)-4-[[4-(methoxymethyl)phenyl]-diphenylmethyl]benzene with MolForge

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Frequently Asked Questions

What is the IUPAC name of 1-(methoxymethyl)-4-[[4-(methoxymethyl)-3-methylphenyl]-diphenylmethyl]-2-methylbenzene;2-(methoxymethyl)-6-[[6-(methoxymethyl)naphthalen-2-yl]-diphenylmethyl]naphthalene;2-(methoxymethyl)-1-[2-(methoxymethyl)naphthalen-1-yl]naphthalene;1-(methoxymethyl)-4-[[4-(methoxymethyl)phenyl]-diphenylmethyl]benzene?
The IUPAC name of 1-(methoxymethyl)-4-[[4-(methoxymethyl)-3-methylphenyl]-diphenylmethyl]-2-methylbenzene;2-(methoxymethyl)-6-[[6-(methoxymethyl)naphthalen-2-yl]-diphenylmethyl]naphthalene;2-(methoxymethyl)-1-[2-(methoxymethyl)naphthalen-1-yl]naphthalene;1-(methoxymethyl)-4-[[4-(methoxymethyl)phenyl]-diphenylmethyl]benzene (CID 163623788) is 1-(methoxymethyl)-4-[[4-(methoxymethyl)-3-methylphenyl]-diphenylmethyl]-2-methylbenzene;2-(methoxymethyl)-6-[[6-(methoxymethyl)naphthalen-2-yl]-diphenylmethyl]naphthalene;2-(methoxymethyl)-1-[2-(methoxymethyl)naphthalen-1-yl]naphthalene;1-(methoxymethyl)-4-[[4-(methoxymethyl)phenyl]-diphenylmethyl]benzene.
What is the SMILES notation for 1-(methoxymethyl)-4-[[4-(methoxymethyl)-3-methylphenyl]-diphenylmethyl]-2-methylbenzene;2-(methoxymethyl)-6-[[6-(methoxymethyl)naphthalen-2-yl]-diphenylmethyl]naphthalene;2-(methoxymethyl)-1-[2-(methoxymethyl)naphthalen-1-yl]naphthalene;1-(methoxymethyl)-4-[[4-(methoxymethyl)phenyl]-diphenylmethyl]benzene?
The canonical SMILES for 1-(methoxymethyl)-4-[[4-(methoxymethyl)-3-methylphenyl]-diphenylmethyl]-2-methylbenzene;2-(methoxymethyl)-6-[[6-(methoxymethyl)naphthalen-2-yl]-diphenylmethyl]naphthalene;2-(methoxymethyl)-1-[2-(methoxymethyl)naphthalen-1-yl]naphthalene;1-(methoxymethyl)-4-[[4-(methoxymethyl)phenyl]-diphenylmethyl]benzene is COCc1ccc(C(c2ccccc2)(c2ccccc2)c2ccc(COC)c(C)c2)cc1C.COCc1ccc(C(c2ccccc2)(c2ccccc2)c2ccc(COC)cc2)cc1.COCc1ccc2cc(C(c3ccccc3)(c3ccccc3)c3ccc4cc(COC)ccc4c3)ccc2c1.COCc1ccc2ccccc2c1-c1c(COC)ccc2ccccc12.
What is the InChIKey of 1-(methoxymethyl)-4-[[4-(methoxymethyl)-3-methylphenyl]-diphenylmethyl]-2-methylbenzene;2-(methoxymethyl)-6-[[6-(methoxymethyl)naphthalen-2-yl]-diphenylmethyl]naphthalene;2-(methoxymethyl)-1-[2-(methoxymethyl)naphthalen-1-yl]naphthalene;1-(methoxymethyl)-4-[[4-(methoxymethyl)phenyl]-diphenylmethyl]benzene?
The InChIKey is HQJFQYJIRLLKGD-UHFFFAOYSA-N. The full InChI is InChI=1S/C37H32O2.C31H32O2.C29H28O2.C24H22O2/c1-38-25-27-13-15-31-23-35(19-17-29(31)21-27)37(33-9-5-3-6-10-33,34-11-7-4-8-12-34)36-20-18-30-22-28(26-39-2)14-16-32(30)24-36;1-23-19-29(17-15-25(23)21-32-3)31(27-11-7-5-8-12-27,28-13-9-6-10-14-28)30-18-16-26(22-33-4)24(2)20-30;1-30-21-23-13-17-27(18-14-23)29(25-9-5-3-6-10-25,26-11-7-4-8-12-26)28-19-15-24(16-20-28)22-31-2;1-25-15-19-13-11-17-7-3-5-9-21(17)23(19)24-20(16-26-2)14-12-18-8-4-6-10-22(18)24/h3-24H,25-26H2,1-2H3;5-20H,21-22H2,1-4H3;3-20H,21-22H2,1-2H3;3-14H,15-16H2,1-2H3.
What are the key properties of 1-(methoxymethyl)-4-[[4-(methoxymethyl)-3-methylphenyl]-diphenylmethyl]-2-methylbenzene;2-(methoxymethyl)-6-[[6-(methoxymethyl)naphthalen-2-yl]-diphenylmethyl]naphthalene;2-(methoxymethyl)-1-[2-(methoxymethyl)naphthalen-1-yl]naphthalene;1-(methoxymethyl)-4-[[4-(methoxymethyl)phenyl]-diphenylmethyl]benzene?
1-(methoxymethyl)-4-[[4-(methoxymethyl)-3-methylphenyl]-diphenylmethyl]-2-methylbenzene;2-(methoxymethyl)-6-[[6-(methoxymethyl)naphthalen-2-yl]-diphenylmethyl]naphthalene;2-(methoxymethyl)-1-[2-(methoxymethyl)naphthalen-1-yl]naphthalene;1-(methoxymethyl)-4-[[4-(methoxymethyl)phenyl]-diphenylmethyl]benzene has a molecular weight of 1696.23 g/mol, XLogP of 27.96, 29 rotatable bonds, 0 hydrogen bond donors, and 8 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(methoxymethyl)-4-[[4-(methoxymethyl)-3-methylphenyl]-diphenylmethyl]-2-methylbenzene;2-(methoxymethyl)-6-[[6-(methoxymethyl)naphthalen-2-yl]-diphenylmethyl]naphthalene;2-(methoxymethyl)-1-[2-(methoxymethyl)naphthalen-1-yl]naphthalene;1-(methoxymethyl)-4-[[4-(methoxymethyl)phenyl]-diphenylmethyl]benzene is sourced from PubChem (CID 163623788), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).