Diphenylmethyl 4-methoxybenzoate
TL;DR: Diphenylmethyl 4-methoxybenzoate (CAS 53914-68-4) is a chemical compound with molecular formula C21H18O3 and molecular weight 318.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
benzhydryl 4-methoxybenzoate
Also Known As: benzhydryl 4-methoxybenzoate, diphenylmethyl 4-methoxybenzoate, Benzhydryl-p-methoxybenzoat, Benzoic acid,4-methoxy-, diphenylmethyl ester, 4-Methoxybenzoic acid benzhydryl ester
| Molecular Formula | C21H18O3 |
|---|---|
| Molecular Weight | 318.13 g/mol |
| LogP | 4.9 |
| Topological Polar Surface Area | 35.5 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 6 |
| Exact Mass | 318.12558 |
| Heavy Atoms | 24 |
| Complexity | 357.0 |
Chemical Identifiers
| CAS Number | 53914-68-4 |
|---|---|
| SMILES | COC1=CC=C(C=C1)C(=O)OC(C2=CC=CC=C2)C3=CC=CC=C3 |
| InChIKey | MKWPWOBGILLSDJ-UHFFFAOYSA-N |
Product Overview
Diphenylmethyl 4-methoxybenzoate (CAS 53914-68-4), with molecular formula C21H18O3 and molecular weight 318.13 g/mol. IUPAC: benzhydryl 4-methoxybenzoate.
Chemical Property Profile of Diphenylmethyl 4-methoxybenzoate
Property Insights of Diphenylmethyl 4-methoxybenzoate
The XLogP value of 4.9 indicates that Diphenylmethyl 4-methoxybenzoate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 35.5 Ų, Diphenylmethyl 4-methoxybenzoate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Diphenylmethyl 4-methoxybenzoate has 0 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Diphenylmethyl 4-methoxybenzoate?
The CAS number of Diphenylmethyl 4-methoxybenzoate is 53914-68-4.
What is the molecular formula of Diphenylmethyl 4-methoxybenzoate?
The molecular formula of Diphenylmethyl 4-methoxybenzoate is C21H18O3.
What is the molecular weight of Diphenylmethyl 4-methoxybenzoate?
The molecular weight of Diphenylmethyl 4-methoxybenzoate is 318.13 g/mol.
Where can I buy Diphenylmethyl 4-methoxybenzoate?
You can request a quote for Diphenylmethyl 4-methoxybenzoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Diphenylmethyl 4-methoxybenzoate?
Yes, KEHONG BIO provides custom synthesis services for Diphenylmethyl 4-methoxybenzoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.