hydrochloride
TL;DR: hydrochloride (CAS 86819-17-2) is a chemical compound with molecular formula C20H28ClNO3 and molecular weight 365.18 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(dimethylamino)-3-[2-[2-(3-methoxyphenyl)ethyl]phenoxy]propan-2-ol;hydrochloride
Also Known As: hydrochloride, null, 1-(Dimethylamino)-3-(2-(3-methoxyphenethyl)phenoxy)propan-2-ol hydrochloride, bp984, Sarpogrelate Metabolite M1 HCl
| Molecular Formula | C20H28ClNO3 |
|---|---|
| Molecular Weight | 365.18 g/mol |
| LogP | 3.2035 |
| Topological Polar Surface Area | 41.93 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 9 |
| Exact Mass | 365.17578 |
| Heavy Atoms | 25 |
| Complexity | 633.84326 |
Chemical Identifiers
| CAS Number | 86819-17-2 |
|---|---|
| SMILES | CN(C)CC(COC1=CC=CC=C1CCC2=CC(=CC=C2)OC)O.Cl |
Product Overview
hydrochloride (CAS 86819-17-2), with molecular formula C20H28ClNO3 and molecular weight 365.18 g/mol. IUPAC: 1-(dimethylamino)-3-[2-[2-(3-methoxyphenyl)ethyl]phenoxy]propan-2-ol;hydrochloride.
Chemical Property Profile of hydrochloride
Property Insights of hydrochloride
The XLogP value of 3.2035 indicates that hydrochloride is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 41.93 Ų, hydrochloride exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, hydrochloride 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 hydrochloride?
The CAS number of hydrochloride is 86819-17-2.
What is the molecular formula of hydrochloride?
The molecular formula of hydrochloride is C20H28ClNO3.
What is the molecular weight of hydrochloride?
The molecular weight of hydrochloride is 365.18 g/mol.
Where can I buy hydrochloride?
You can request a quote for hydrochloride directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for hydrochloride?
Yes, KEHONG BIO provides custom synthesis services for hydrochloride and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.