Methyldopate Hydrochloride
TL;DR: Methyldopate Hydrochloride (CAS 2508-79-4) is a chemical compound with molecular formula C12H18ClNO4 and molecular weight 275.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl (2S)-2-amino-3-(3,4-dihydroxyphenyl)-2-methylpropanoate;hydrochloride
Also Known As: METHYLDOPATE HYDROCHLORIDE, Methyldopate HCL, Aldomet, Aldomet Ester hydrochloride, METHYLDOPATE
| Molecular Formula | C12H18ClNO4 |
|---|---|
| Molecular Weight | 275.09 g/mol |
| LogP | 1.34 |
| Topological Polar Surface Area | 92.8 Ų |
| Hydrogen Bond Donors | 4 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 5 |
| Exact Mass | 275.09244 |
| Heavy Atoms | 18 |
| Complexity | 271.0 |
Chemical Identifiers
| CAS Number | 2508-79-4 |
|---|---|
| SMILES | CCOC(=O)[C@](C)(CC1=CC(=C(C=C1)O)O)N.Cl |
| InChIKey | QSRVZCCJDKYRRF-YDALLXLXSA-N |
Patent-Derived Application Labels
Derived from 8 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Methyldopate Hydrochloride (CAS 2508-79-4), with molecular formula C12H18ClNO4 and molecular weight 275.09 g/mol. IUPAC: ethyl (2S)-2-amino-3-(3,4-dihydroxyphenyl)-2-methylpropanoate;hydrochloride.
Chemical Property Profile of Methyldopate Hydrochloride
Property Insights of Methyldopate Hydrochloride
The XLogP value of 1.34 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Methyldopate Hydrochloride. The TPSA of 92.8 Ų falls within the moderate polarity range, balancing permeability and solubility for Methyldopate Hydrochloride. Following Lipinski's Rule of Five, Methyldopate Hydrochloride has 4 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 Methyldopate Hydrochloride?
The CAS number of Methyldopate Hydrochloride is 2508-79-4.
What is the molecular formula of Methyldopate Hydrochloride?
The molecular formula of Methyldopate Hydrochloride is C12H18ClNO4.
What is the molecular weight of Methyldopate Hydrochloride?
The molecular weight of Methyldopate Hydrochloride is 275.09 g/mol.
Where can I buy Methyldopate Hydrochloride?
You can request a quote for Methyldopate Hydrochloride directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Methyldopate Hydrochloride?
Yes, KEHONG BIO provides custom synthesis services for Methyldopate Hydrochloride and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.