辛卡因
TL;DR: 辛卡因 (CAS 126-27-2) is a chemical compound with molecular formula C28H41N3O3 and molecular weight 467.31 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
辛卡因
2-[2-hydroxyethyl-[2-[methyl-(2-methyl-1-phenylpropan-2-yl)amino]-2-oxoethyl]amino]-N-methyl-N-(2-methyl-1-phenylpropan-2-yl)acetamide
Also Known As: Oxethazaine, Oxetacaine, Oxethacaine, Mucaine, Oxaine
| Molecular Formula | C28H41N3O3 |
|---|---|
| Molecular Weight | 467.31 g/mol |
| LogP | 3.8 |
| Topological Polar Surface Area | 64.1 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 12 |
| Exact Mass | 467.3148 |
| Heavy Atoms | 34 |
| Complexity | 585.0 |
| Melting Point | 219 to 104.4 °C |
| Boiling Point | 630 |
| Solubility | less than 1 mg/mL at 73 °F (NTP, 1992) |
Chemical Identifiers
| CAS Number | 126-27-2 |
|---|---|
| SMILES | CC(C)(CC1=CC=CC=C1)N(C)C(=O)CN(CCO)CC(=O)N(C)C(C)(C)CC2=CC=CC=C2 |
| InChIKey | FTLDJPRFCGDUFH-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 8 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
辛卡因 (CAS 126-27-2), with molecular formula C28H41N3O3 and molecular weight 467.31 g/mol. IUPAC: 2-[2-hydroxyethyl-[2-[methyl-(2-methyl-1-phenylpropan-2-yl)amino]-2-oxoethyl]amino]-N-methyl-N-(2-methyl-1-phenylpropan-2-yl)acetamide.
Chemical Property Profile of 辛卡因
Property Insights of 辛卡因
The XLogP value of 3.8 indicates that 奥昔卡因 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 64.1 Ų falls within the moderate polarity range, balancing permeability and solubility for 辛卡因. Following Lipinski's Rule of Five, 奥昔卡因 has 1 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 奥昔卡因?
The CAS number of 奥昔卡因 is 126-27-2.
What is the molecular formula of 奥昔卡因?
The molecular formula of 奥昔卡因 is C28H41N3O3.
What is the molecular weight of 奥昔卡因?
The molecular weight of 奥昔卡因 is 467.31 g/mol.
Where can I buy 奥昔卡因?
You can request a quote for 奥昔卡因 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 奥昔卡因?
Yes, KEHONG BIO provides custom synthesis services for 奥昔卡因 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.