可樂定
TL;DR: 可樂定 (CAS 4205-90-7) is a chemical compound with molecular formula C9H9Cl2N3 and molecular weight 229.02 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
可樂定
N-(2,6-dichlorophenyl)-4,5-dihydro-1H-imidazol-2-amine
Also Known As: clonidine, Clonidin, Chlornidinum, Catapres, Duraclon
| Molecular Formula | C9H9Cl2N3 |
|---|---|
| Molecular Weight | 229.02 g/mol |
| LogP | 1.6 |
| Topological Polar Surface Area | 36.4 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 2 |
| Exact Mass | 229.01735 |
| Heavy Atoms | 14 |
| Complexity | 222.0 |
| Melting Point | 130 |
| Solubility | Insoluble in water |
Chemical Identifiers
| CAS Number | 4205-90-7 |
|---|---|
| SMILES | C1CN=C(N1)NC2=C(C=CC=C2Cl)Cl |
| InChIKey | GJSURZIOUXUGAL-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 19 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
可樂定 (CAS 4205-90-7), with molecular formula C9H9Cl2N3 and molecular weight 229.02 g/mol. IUPAC: N-(2,6-dichlorophenyl)-4,5-dihydro-1H-imidazol-2-amine.
Chemical Property Profile of 可樂定
Property Insights of 可樂定
The XLogP value of 1.6 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 可樂定. With a topological polar surface area (TPSA) of 36.4 Ų, 可樂定 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 可樂定 has 2 hydrogen bond donor(s) and 1 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 可樂定?
The CAS number of 可樂定 is 4205-90-7.
What is the molecular formula of 可樂定?
The molecular formula of 可樂定 is C9H9Cl2N3.
What is the molecular weight of 可樂定?
The molecular weight of 可樂定 is 229.02 g/mol.
Where can I buy 可樂定?
You can request a quote for 可樂定 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 可樂定?
Yes, KEHONG BIO provides custom synthesis services for 可樂定 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.