4-碘可乐定
TL;DR: 4-碘可乐定 (CAS 108294-53-7) is a chemical compound with molecular formula C9H8Cl2IN3 and molecular weight 354.91 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-碘可乐定
N-(2,6-dichloro-4-iodophenyl)-4,5-dihydro-1H-imidazol-2-amine
Also Known As: p-Iodoclonidine, 4-iodoclonidine, PI-CLONIDINE, p-Iodoclonidine hydrochloride, Lopac-I-114
| Molecular Formula | C9H8Cl2IN3 |
|---|---|
| Molecular Weight | 354.91 g/mol |
| LogP | 2.2 |
| Topological Polar Surface Area | 36.4 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 2 |
| Exact Mass | 354.914 |
| Heavy Atoms | 15 |
| Complexity | 250.0 |
Chemical Identifiers
| CAS Number | 108294-53-7 |
|---|---|
| SMILES | C1CN=C(N1)NC2=C(C=C(C=C2Cl)I)Cl |
| InChIKey | HSRPTPAPMBHRRJ-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 6 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
4-碘可乐定 (CAS 108294-53-7), with molecular formula C9H8Cl2IN3 and molecular weight 354.91 g/mol. IUPAC: N-(2,6-dichloro-4-iodophenyl)-4,5-dihydro-1H-imidazol-2-amine.
Chemical Property Profile of 4-碘可乐定
Property Insights of 4-碘可乐定
The XLogP value of 2.2 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-碘可乐定. With a topological polar surface area (TPSA) of 36.4 Ų, 4-碘可乐定 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4-Iodoclonidine 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 4-Iodoclonidine?
The CAS number of 4-Iodoclonidine is 108294-53-7.
What is the molecular formula of 4-Iodoclonidine?
The molecular formula of 4-Iodoclonidine is C9H8Cl2IN3.
What is the molecular weight of 4-Iodoclonidine?
The molecular weight of 4-Iodoclonidine is 354.91 g/mol.
Where can I buy 4-Iodoclonidine?
You can request a quote for 4-Iodoclonidine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-Iodoclonidine?
Yes, KEHONG BIO provides custom synthesis services for 4-Iodoclonidine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.