(4-Bromophenyl)methyl 2-(furan-2-carbonylamino)acetate
TL;DR: (4-Bromophenyl)methyl 2-(furan-2-carbonylamino)acetate (CAS 516466-58-3) is a chemical compound with molecular formula C14H12BrNO4 and molecular weight 336.99 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(4-bromophenyl)methyl 2-(furan-2-carbonylamino)acetate
Also Known As: 4-bromobenzyl 2-(furan-2-carboxamido)acetate, (4-bromophenyl)methyl 2-(furan-2-carbonylamino)acetate, 4-bromobenzyl N-(furan-2-ylcarbonyl)glycinate, (4-Bromophenyl)methyl N-(furan-2-carbonyl)glycinate, (4-bromophenyl)methyl 2-(2-furylcarbonylamino)acetate
| Molecular Formula | C14H12BrNO4 |
|---|---|
| Molecular Weight | 336.99 g/mol |
| LogP | 2.4 |
| Topological Polar Surface Area | 68.5 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 6 |
| Exact Mass | 336.99496 |
| Heavy Atoms | 20 |
| Complexity | 342.0 |
Chemical Identifiers
| CAS Number | 516466-58-3 |
|---|---|
| SMILES | C1=COC(=C1)C(=O)NCC(=O)OCC2=CC=C(C=C2)Br |
| InChIKey | YPXGZTWAPZAIAE-UHFFFAOYSA-N |
Product Overview
(4-Bromophenyl)methyl 2-(furan-2-carbonylamino)acetate (CAS 516466-58-3), with molecular formula C14H12BrNO4 and molecular weight 336.99 g/mol. IUPAC: (4-bromophenyl)methyl 2-(furan-2-carbonylamino)acetate.
Chemical Property Profile of (4-Bromophenyl)methyl 2-(furan-2-carbonylamino)acetate
Property Insights of (4-Bromophenyl)methyl 2-(furan-2-carbonylamino)acetate
The XLogP value of 2.4 suggests moderate lipophilicity, balancing water solubility and membrane permeability for (4-Bromophenyl)methyl 2-(furan-2-carbonylamino)acetate. The TPSA of 68.5 Ų falls within the moderate polarity range, balancing permeability and solubility for (4-Bromophenyl)methyl 2-(furan-2-carbonylamino)acetate. Following Lipinski's Rule of Five, (4-Bromophenyl)methyl 2-(furan-2-carbonylamino)acetate has 1 hydrogen bond donor(s) and 4 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-Bromophenyl)methyl 2-(furan-2-carbonylamino)acetate?
The CAS number of (4-Bromophenyl)methyl 2-(furan-2-carbonylamino)acetate is 516466-58-3.
What is the molecular formula of (4-Bromophenyl)methyl 2-(furan-2-carbonylamino)acetate?
The molecular formula of (4-Bromophenyl)methyl 2-(furan-2-carbonylamino)acetate is C14H12BrNO4.
What is the molecular weight of (4-Bromophenyl)methyl 2-(furan-2-carbonylamino)acetate?
The molecular weight of (4-Bromophenyl)methyl 2-(furan-2-carbonylamino)acetate is 336.99 g/mol.
Where can I buy (4-Bromophenyl)methyl 2-(furan-2-carbonylamino)acetate?
You can request a quote for (4-Bromophenyl)methyl 2-(furan-2-carbonylamino)acetate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (4-Bromophenyl)methyl 2-(furan-2-carbonylamino)acetate?
Yes, KEHONG BIO provides custom synthesis services for (4-Bromophenyl)methyl 2-(furan-2-carbonylamino)acetate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.