Ici 198157
TL;DR: Ici 198157 (CAS 107332-62-7) is a chemical compound with molecular formula C20H26ClNO6 and molecular weight 411.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl 2-[4-[2-[(2-hydroxy-3-phenoxypropyl)amino]ethoxy]phenoxy]acetate;hydrochloride
Also Known As: Ici 198157, Methyl (+-)-(4-(2-((2-hydroxy-3-phenoxypropyl)amino)ethoxy)phenoxy)acetate, methyl 2-[4-[2-[(2-hydroxy-3-phenoxypropyl)amino]ethoxy]phenoxy]acetate;hydrochloride, methyl 2-[4-[2-[(2-hydroxy-3-phenoxypropyl)amino]ethoxy]phenoxy]acetate, methyl 2-[4-[2-[(2-hydroxy-3-phenoxypropyl)amino]ethoxy]phenoxy]acetate hydrochloride
| Molecular Formula | C20H26ClNO6 |
|---|---|
| Molecular Weight | 411.14 g/mol |
| LogP | 2.0685 |
| Topological Polar Surface Area | 86.3 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 13 |
| Exact Mass | 411.14487 |
| Heavy Atoms | 28 |
| Complexity | 394.0 |
Chemical Identifiers
| CAS Number | 107332-62-7 |
|---|---|
| SMILES | COC(=O)COC1=CC=C(C=C1)OCCNCC(COC2=CC=CC=C2)O.Cl |
| InChIKey | MVQOMOXWRUVMOG-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 3 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Ici 198157 (CAS 107332-62-7), with molecular formula C20H26ClNO6 and molecular weight 411.14 g/mol. IUPAC: methyl 2-[4-[2-[(2-hydroxy-3-phenoxypropyl)amino]ethoxy]phenoxy]acetate;hydrochloride.
Chemical Property Profile of Ici 198157
Property Insights of Ici 198157
The XLogP value of 2.0685 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Ici 198157. The TPSA of 86.3 Ų falls within the moderate polarity range, balancing permeability and solubility for Ici 198157. Following Lipinski's Rule of Five, Ici 198157 has 3 hydrogen bond donor(s) and 7 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 Ici 198157?
The CAS number of Ici 198157 is 107332-62-7.
What is the molecular formula of Ici 198157?
The molecular formula of Ici 198157 is C20H26ClNO6.
What is the molecular weight of Ici 198157?
The molecular weight of Ici 198157 is 411.14 g/mol.
Where can I buy Ici 198157?
You can request a quote for Ici 198157 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Ici 198157?
Yes, KEHONG BIO provides custom synthesis services for Ici 198157 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.