Methyl 2-(5-((3,4-dimethylphenoxy)methyl)furan-2-carboxamido)benzoate
TL;DR: Methyl 2-(5-((3,4-dimethylphenoxy)methyl)furan-2-carboxamido)benzoate (CAS 445239-26-9) is a chemical compound with molecular formula C22H21NO5 and molecular weight 379.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl 2-[[5-[(3,4-dimethylphenoxy)methyl]furan-2-carbonyl]amino]benzoate
Also Known As: Methyl 2-(5-((3,4-dimethylphenoxy)methyl)furan-2-carboxamido)benzoate, methyl 2-[[5-[(3,4-dimethylphenoxy)methyl]furan-2-carbonyl]amino]benzoate, methyl 2-({5-[(3,4-dimethylphenoxy)methyl]-2-furoyl}amino)benzoate, methyl 2-({5-[(3,4-dimethylphenoxy)methyl]-2-furyl}carbonylamino)benzoate, METHYL 2-[5-(3,4-DIMETHYLPHENOXYMETHYL)FURAN-2-AMIDO]BENZOATE
| Molecular Formula | C22H21NO5 |
|---|---|
| Molecular Weight | 379.14 g/mol |
| LogP | 4.51434 |
| Topological Polar Surface Area | 77.77 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 6 |
| Exact Mass | 379.14197 |
| Heavy Atoms | 28 |
| Complexity | 1005.6666 |
Chemical Identifiers
| CAS Number | 445239-26-9 |
|---|---|
| SMILES | CC1=C(C=C(C=C1)OCC2=CC=C(O2)C(=O)NC3=CC=CC=C3C(=O)OC)C |
Product Overview
Methyl 2-(5-((3,4-dimethylphenoxy)methyl)furan-2-carboxamido)benzoate (CAS 445239-26-9), with molecular formula C22H21NO5 and molecular weight 379.14 g/mol. IUPAC: methyl 2-[[5-[(3,4-dimethylphenoxy)methyl]furan-2-carbonyl]amino]benzoate.
Chemical Property Profile of Methyl 2-(5-((3,4-dimethylphenoxy)methyl)furan-2-carboxamido)benzoate
Property Insights of Methyl 2-(5-((3,4-dimethylphenoxy)methyl)furan-2-carboxamido)benzoate
The XLogP value of 4.51434 indicates that Methyl 2-(5-((3,4-dimethylphenoxy)methyl)furan-2-carboxamido)benzoate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 77.77 Ų falls within the moderate polarity range, balancing permeability and solubility for Methyl 2-(5-((3,4-dimethylphenoxy)methyl)furan-2-carboxamido)benzoate. Following Lipinski's Rule of Five, Methyl 2-(5-((3,4-dimethylphenoxy)methyl)furan-2-carboxamido)benzoate has 1 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 2-(5-((3,4-dimethylphenoxy)methyl)furan-2-carboxamido)benzoate?
The CAS number of Methyl 2-(5-((3,4-dimethylphenoxy)methyl)furan-2-carboxamido)benzoate is 445239-26-9.
What is the molecular formula of Methyl 2-(5-((3,4-dimethylphenoxy)methyl)furan-2-carboxamido)benzoate?
The molecular formula of Methyl 2-(5-((3,4-dimethylphenoxy)methyl)furan-2-carboxamido)benzoate is C22H21NO5.
What is the molecular weight of Methyl 2-(5-((3,4-dimethylphenoxy)methyl)furan-2-carboxamido)benzoate?
The molecular weight of Methyl 2-(5-((3,4-dimethylphenoxy)methyl)furan-2-carboxamido)benzoate is 379.14 g/mol.
Where can I buy Methyl 2-(5-((3,4-dimethylphenoxy)methyl)furan-2-carboxamido)benzoate?
You can request a quote for Methyl 2-(5-((3,4-dimethylphenoxy)methyl)furan-2-carboxamido)benzoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Methyl 2-(5-((3,4-dimethylphenoxy)methyl)furan-2-carboxamido)benzoate?
Yes, KEHONG BIO provides custom synthesis services for Methyl 2-(5-((3,4-dimethylphenoxy)methyl)furan-2-carboxamido)benzoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.