1,3-Phenylene bis(4-aminobenzoate)
TL;DR: 1,3-Phenylene bis(4-aminobenzoate) (CAS 142280-58-8) is a chemical compound with molecular formula C20H16N2O4 and molecular weight 348.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[3-(4-aminobenzoyl)oxyphenyl] 4-aminobenzoate
Also Known As: 1,3-Phenylene bis(4-aminobenzoate), 1,3-bis(4-aminobenzoyloxy)benzene, [3-(4-aminobenzoyl)oxyphenyl] 4-aminobenzoate, 3-(4-aminobenzoyloxy)phenyl 4-aminobenzoate, Bis(4-aminobenzoic acid)1,3-phenylene ester
| Molecular Formula | C20H16N2O4 |
|---|---|
| Molecular Weight | 348.11 g/mol |
| LogP | 3.2894 |
| Topological Polar Surface Area | 104.64 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 4 |
| Exact Mass | 348.111 |
| Heavy Atoms | 26 |
| Complexity | 860.03485 |
Chemical Identifiers
| CAS Number | 142280-58-8 |
|---|---|
| SMILES | C1=CC(=CC(=C1)OC(=O)C2=CC=C(C=C2)N)OC(=O)C3=CC=C(C=C3)N |
Product Overview
1,3-Phenylene bis(4-aminobenzoate) (CAS 142280-58-8), with molecular formula C20H16N2O4 and molecular weight 348.11 g/mol. IUPAC: [3-(4-aminobenzoyl)oxyphenyl] 4-aminobenzoate.
Chemical Property Profile of 1,3-Phenylene bis(4-aminobenzoate)
Property Insights of 1,3-Phenylene bis(4-aminobenzoate)
The XLogP value of 3.2894 indicates that 1,3-Phenylene bis(4-aminobenzoate) is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 104.64 Ų falls within the moderate polarity range, balancing permeability and solubility for 1,3-Phenylene bis(4-aminobenzoate). Following Lipinski's Rule of Five, 1,3-Phenylene bis(4-aminobenzoate) has 2 hydrogen bond donor(s) and 6 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 1,3-Phenylene bis(4-aminobenzoate)?
The CAS number of 1,3-Phenylene bis(4-aminobenzoate) is 142280-58-8.
What is the molecular formula of 1,3-Phenylene bis(4-aminobenzoate)?
The molecular formula of 1,3-Phenylene bis(4-aminobenzoate) is C20H16N2O4.
What is the molecular weight of 1,3-Phenylene bis(4-aminobenzoate)?
The molecular weight of 1,3-Phenylene bis(4-aminobenzoate) is 348.11 g/mol.
Where can I buy 1,3-Phenylene bis(4-aminobenzoate)?
You can request a quote for 1,3-Phenylene bis(4-aminobenzoate) directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1,3-Phenylene bis(4-aminobenzoate)?
Yes, KEHONG BIO provides custom synthesis services for 1,3-Phenylene bis(4-aminobenzoate) and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.