4-Amidinophenyl benzoate
TL;DR: 4-Amidinophenyl benzoate (CAS 53483-12-8) is a chemical compound with molecular formula C14H12N2O2 and molecular weight 240.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(4-carbamimidoylphenyl) benzoate
Also Known As: 4-Amidinophenyl benzoate, 4-Amidinophenylbenzoate, p-amidinophenyl benzoate, 4-carbamimidoylphenyl benzoate, (4-carbamimidoylphenyl) benzoate
| Molecular Formula | C14H12N2O2 |
|---|---|
| Molecular Weight | 240.09 g/mol |
| LogP | 2.6 |
| Topological Polar Surface Area | 76.2 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 240.08987 |
| Heavy Atoms | 18 |
| Complexity | 303.0 |
Chemical Identifiers
| CAS Number | 53483-12-8 |
|---|---|
| SMILES | C1=CC=C(C=C1)C(=O)OC2=CC=C(C=C2)C(=N)N |
| InChIKey | FXWXBLXPGAZOHE-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 4 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
4-Amidinophenyl benzoate (CAS 53483-12-8), with molecular formula C14H12N2O2 and molecular weight 240.09 g/mol. IUPAC: (4-carbamimidoylphenyl) benzoate.
Chemical Property Profile of 4-Amidinophenyl benzoate
Property Insights of 4-Amidinophenyl benzoate
The XLogP value of 2.6 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-Amidinophenyl benzoate. The TPSA of 76.2 Ų falls within the moderate polarity range, balancing permeability and solubility for 4-Amidinophenyl benzoate. Following Lipinski's Rule of Five, 4-Amidinophenyl benzoate has 2 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 4-Amidinophenyl benzoate?
The CAS number of 4-Amidinophenyl benzoate is 53483-12-8.
What is the molecular formula of 4-Amidinophenyl benzoate?
The molecular formula of 4-Amidinophenyl benzoate is C14H12N2O2.
What is the molecular weight of 4-Amidinophenyl benzoate?
The molecular weight of 4-Amidinophenyl benzoate is 240.09 g/mol.
Where can I buy 4-Amidinophenyl benzoate?
You can request a quote for 4-Amidinophenyl benzoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-Amidinophenyl benzoate?
Yes, KEHONG BIO provides custom synthesis services for 4-Amidinophenyl benzoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.