SKF 1-39728 hydrochloride
TL;DR: SKF 1-39728 hydrochloride (CAS 3549-18-6) is a chemical compound with molecular formula C17H19ClF3NO and molecular weight 345.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-benzyl-2-methoxy-2-[3-(trifluoromethyl)phenyl]ethanamine;hydrochloride
Also Known As: SKF 1-39728 hydrochloride, SK and F l-39728-A, 5-HYDROXY-3-PHENYLBENZOIC ACID, N-Benzyl-beta-methoxy-m-trifluoromethylphenethylamine hydrochloride, Benzeneethanamine, beta-methoxy-N-(phenylmethyl)-3-(trifluoromethyl)-, hydrochloride
| Molecular Formula | C17H19ClF3NO |
|---|---|
| Molecular Weight | 345.11 g/mol |
| LogP | 4.6 |
| Topological Polar Surface Area | 21.3 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 6 |
| Exact Mass | 345.11072 |
| Heavy Atoms | 23 |
| Complexity | 316.0 |
Chemical Identifiers
| CAS Number | 3549-18-6 |
|---|---|
| SMILES | COC(CNCC1=CC=CC=C1)C2=CC(=CC=C2)C(F)(F)F.Cl |
| InChIKey | ZCRYJNQQXADLBG-UHFFFAOYSA-N |
Product Overview
SKF 1-39728 hydrochloride (CAS 3549-18-6), with molecular formula C17H19ClF3NO and molecular weight 345.11 g/mol. IUPAC: N-benzyl-2-methoxy-2-[3-(trifluoromethyl)phenyl]ethanamine;hydrochloride.
Chemical Property Profile of SKF 1-39728 hydrochloride
Property Insights of SKF 1-39728 hydrochloride
The XLogP value of 4.6 indicates that SKF 1-39728 hydrochloride is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 21.3 Ų, SKF 1-39728 hydrochloride exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, SKF 1-39728 hydrochloride has 2 hydrogen bond donor(s) and 5 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 SKF 1-39728 hydrochloride?
The CAS number of SKF 1-39728 hydrochloride is 3549-18-6.
What is the molecular formula of SKF 1-39728 hydrochloride?
The molecular formula of SKF 1-39728 hydrochloride is C17H19ClF3NO.
What is the molecular weight of SKF 1-39728 hydrochloride?
The molecular weight of SKF 1-39728 hydrochloride is 345.11 g/mol.
Where can I buy SKF 1-39728 hydrochloride?
You can request a quote for SKF 1-39728 hydrochloride directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for SKF 1-39728 hydrochloride?
Yes, KEHONG BIO provides custom synthesis services for SKF 1-39728 hydrochloride and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.