美布他明
TL;DR: 美布他明 (CAS 4439-25-2) is a chemical compound with molecular formula C13H20N2O2 and molecular weight 236.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
美布他明
2-(2-methylpropylamino)ethyl 3-aminobenzoate
Also Known As: METABUTETHAMINE, metabuthamine, Unacaine hydrochloride, METABUTETHAMINE [WHO-DD], 2-(2-methylpropylamino)ethyl 3-aminobenzoate
| Molecular Formula | C13H20N2O2 |
|---|---|
| Molecular Weight | 236.15 g/mol |
| LogP | 2.0 |
| Topological Polar Surface Area | 64.4 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 7 |
| Exact Mass | 236.15248 |
| Heavy Atoms | 17 |
| Complexity | 231.0 |
Chemical Identifiers
| CAS Number | 4439-25-2 |
|---|---|
| SMILES | CC(C)CNCCOC(=O)C1=CC(=CC=C1)N |
| InChIKey | BXMFKNRZTLNAFY-UHFFFAOYSA-N |
Product Overview
美布他明 (CAS 4439-25-2), with molecular formula C13H20N2O2 and molecular weight 236.15 g/mol. IUPAC: 2-(2-methylpropylamino)ethyl 3-aminobenzoate.
Chemical Property Profile of 美布他明
Property Insights of 美布他明
The XLogP value of 2.0 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 美布他明. The TPSA of 64.4 Ų falls within the moderate polarity range, balancing permeability and solubility for 美布他明. Following Lipinski's Rule of Five, 美布他明 has 2 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 美布他明?
The CAS number of 美布他明 is 4439-25-2.
What is the molecular formula of 美布他明?
The molecular formula of 美布他明 is C13H20N2O2.
What is the molecular weight of 美布他明?
The molecular weight of 美布他明 is 236.15 g/mol.
Where can I buy 美布他明?
You can request a quote for 美布他明 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 美布他明?
Yes, KEHONG BIO provides custom synthesis services for 美布他明 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.