西拉唑啉
TL;DR: 西拉唑啉 (CAS 59939-16-1) is a chemical compound with molecular formula C13H16N2O and molecular weight 216.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
西拉唑啉
2-[(2-cyclopropylphenoxy)methyl]-4,5-dihydro-1H-imidazole
Also Known As: cirazoline, Cirazolina, Cirazolinum, Cirazoline [INN], Cirazoline hydrochloride
| Molecular Formula | C13H16N2O |
|---|---|
| Molecular Weight | 216.13 g/mol |
| LogP | 1.8 |
| Topological Polar Surface Area | 33.6 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 4 |
| Exact Mass | 216.12627 |
| Heavy Atoms | 16 |
| Complexity | 273.0 |
Chemical Identifiers
| CAS Number | 59939-16-1 |
|---|---|
| SMILES | C1CC1C2=CC=CC=C2OCC3=NCCN3 |
| InChIKey | YAORIDZYZDUZCM-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 8 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
西拉唑啉 (CAS 59939-16-1), with molecular formula C13H16N2O and molecular weight 216.13 g/mol. IUPAC: 2-[(2-cyclopropylphenoxy)methyl]-4,5-dihydro-1H-imidazole.
Chemical Property Profile of 西拉唑啉
Property Insights of 西拉唑啉
The XLogP value of 1.8 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 西拉唑啉. With a topological polar surface area (TPSA) of 33.6 Ų, 西拉唑啉 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 西拉唑啉 has 1 hydrogen bond donor(s) and 2 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 西拉唑啉?
The CAS number of 西拉唑啉 is 59939-16-1.
What is the molecular formula of 西拉唑啉?
The molecular formula of 西拉唑啉 is C13H16N2O.
What is the molecular weight of 西拉唑啉?
The molecular weight of 西拉唑啉 is 216.13 g/mol.
Where can I buy 西拉唑啉?
You can request a quote for 西拉唑啉 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 西拉唑啉?
Yes, KEHONG BIO provides custom synthesis services for 西拉唑啉 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.