![Methyl 4-{3-[(2-furylmethyl)amino]propanoylamino}benzoate structure](/static/products/7261/726159-67-7.webp)
Methyl 4-{3-[(2-furylmethyl)amino]propanoylamino}benzoate
TL;DR: Methyl 4-{3-[(2-furylmethyl)amino]propanoylamino}benzoate (CAS 726159-67-7) is a chemical compound with molecular formula C16H18N2O4 and molecular weight 302.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl 4-[3-(furan-2-ylmethylamino)propanoylamino]benzoate
Also Known As: F1678-0208, methyl p-[3-(furfurylamino)propionylamino]benzoate, methyl 4-[3-(furan-2-ylmethylamino)propanoylamino]benzoate, methyl 4-{3-[(2-furylmethyl)amino]propanoylamino}benzoate, methyl 4-(3-{[(furan-2-yl)methyl]amino}propanamido)benzoate
| Molecular Formula | C16H18N2O4 |
|---|---|
| Molecular Weight | 302.13 g/mol |
| LogP | 2.1846 |
| Topological Polar Surface Area | 80.57 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 7 |
| Exact Mass | 302.12665 |
| Heavy Atoms | 22 |
| Complexity | 605.5859 |
Chemical Identifiers
| CAS Number | 726159-67-7 |
|---|---|
| SMILES | COC(=O)C1=CC=C(C=C1)NC(=O)CCNCC2=CC=CO2 |
Product Overview
Methyl 4-{3-[(2-furylmethyl)amino]propanoylamino}benzoate (CAS 726159-67-7), with molecular formula C16H18N2O4 and molecular weight 302.13 g/mol. IUPAC: methyl 4-[3-(furan-2-ylmethylamino)propanoylamino]benzoate.
Chemical Property Profile of Methyl 4-{3-[(2-furylmethyl)amino]propanoylamino}benzoate
Property Insights of Methyl 4-{3-[(2-furylmethyl)amino]propanoylamino}benzoate
The XLogP value of 2.1846 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Methyl 4-{3-[(2-furylmethyl)amino]propanoylamino}benzoate. The TPSA of 80.57 Ų falls within the moderate polarity range, balancing permeability and solubility for Methyl 4-{3-[(2-furylmethyl)amino]propanoylamino}benzoate. Following Lipinski's Rule of Five, Methyl 4-{3-[(2-furylmethyl)amino]propanoylamino}benzoate has 2 hydrogen bond donor(s) and 5 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 Methyl 4-{3-[(2-furylmethyl)amino]propanoylamino}benzoate?
The CAS number of Methyl 4-{3-[(2-furylmethyl)amino]propanoylamino}benzoate is 726159-67-7.
What is the molecular formula of Methyl 4-{3-[(2-furylmethyl)amino]propanoylamino}benzoate?
The molecular formula of Methyl 4-{3-[(2-furylmethyl)amino]propanoylamino}benzoate is C16H18N2O4.
What is the molecular weight of Methyl 4-{3-[(2-furylmethyl)amino]propanoylamino}benzoate?
The molecular weight of Methyl 4-{3-[(2-furylmethyl)amino]propanoylamino}benzoate is 302.13 g/mol.
Where can I buy Methyl 4-{3-[(2-furylmethyl)amino]propanoylamino}benzoate?
You can request a quote for Methyl 4-{3-[(2-furylmethyl)amino]propanoylamino}benzoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Methyl 4-{3-[(2-furylmethyl)amino]propanoylamino}benzoate?
Yes, KEHONG BIO provides custom synthesis services for Methyl 4-{3-[(2-furylmethyl)amino]propanoylamino}benzoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.