![methyl N-{[4-(3-methylbutoxy)phenyl]carbonyl}tyrosinate structure](/static/products/100/1009240-19-0.png)
methyl N-{[4-(3-methylbutoxy)phenyl]carbonyl}tyrosinate
TL;DR: methyl N-{[4-(3-methylbutoxy)phenyl]carbonyl}tyrosinate (CAS 1009240-19-0) is a chemical compound with molecular formula C22H27NO5 and molecular weight 385.19 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl 3-(4-hydroxyphenyl)-2-[[4-(3-methylbutoxy)benzoyl]amino]propanoate
Also Known As: methyl N-{[4-(3-methylbutoxy)phenyl]carbonyl}tyrosinate, A3727/0157948, methyl 3-(4-hydroxyphenyl)-2-(4-(isopentyloxy)benzamido)propanoate, methyl 3-(4-hydroxyphenyl)-2-[[4-(3-methylbutoxy)benzoyl]amino]propanoate, Benzenepropanoic acid, 4-hydroxy-.alpha.-[[4-(3-methylbutoxy)benzoyl]amino]-, methyl ester
| Molecular Formula | C22H27NO5 |
|---|---|
| Molecular Weight | 385.19 g/mol |
| LogP | 3.3312 |
| Topological Polar Surface Area | 84.86 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 9 |
| Exact Mass | 385.18893 |
| Heavy Atoms | 28 |
| Complexity | 768.51904 |
Chemical Identifiers
| CAS Number | 1009240-19-0 |
|---|---|
| SMILES | CC(C)CCOC1=CC=C(C=C1)C(=O)NC(CC2=CC=C(C=C2)O)C(=O)OC |
Product Overview
methyl N-{[4-(3-methylbutoxy)phenyl]carbonyl}tyrosinate (CAS 1009240-19-0), with molecular formula C22H27NO5 and molecular weight 385.19 g/mol. IUPAC: methyl 3-(4-hydroxyphenyl)-2-[[4-(3-methylbutoxy)benzoyl]amino]propanoate.
Chemical Property Profile of methyl N-{[4-(3-methylbutoxy)phenyl]carbonyl}tyrosinate
Property Insights of methyl N-{[4-(3-methylbutoxy)phenyl]carbonyl}tyrosinate
The XLogP value of 3.3312 indicates that methyl N-{[4-(3-methylbutoxy)phenyl]carbonyl}tyrosinate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 84.86 Ų falls within the moderate polarity range, balancing permeability and solubility for methyl N-{[4-(3-methylbutoxy)phenyl]carbonyl}tyrosinate. Following Lipinski's Rule of Five, methyl N-{[4-(3-methylbutoxy)phenyl]carbonyl}tyrosinate 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 N-{[4-(3-methylbutoxy)phenyl]carbonyl}tyrosinate?
The CAS number of methyl N-{[4-(3-methylbutoxy)phenyl]carbonyl}tyrosinate is 1009240-19-0.
What is the molecular formula of methyl N-{[4-(3-methylbutoxy)phenyl]carbonyl}tyrosinate?
The molecular formula of methyl N-{[4-(3-methylbutoxy)phenyl]carbonyl}tyrosinate is C22H27NO5.
What is the molecular weight of methyl N-{[4-(3-methylbutoxy)phenyl]carbonyl}tyrosinate?
The molecular weight of methyl N-{[4-(3-methylbutoxy)phenyl]carbonyl}tyrosinate is 385.19 g/mol.
Where can I buy methyl N-{[4-(3-methylbutoxy)phenyl]carbonyl}tyrosinate?
You can request a quote for methyl N-{[4-(3-methylbutoxy)phenyl]carbonyl}tyrosinate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for methyl N-{[4-(3-methylbutoxy)phenyl]carbonyl}tyrosinate?
Yes, KEHONG BIO provides custom synthesis services for methyl N-{[4-(3-methylbutoxy)phenyl]carbonyl}tyrosinate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.