trans-6-Chloro-4-(2-fluorophenyl)-2-(2-propylaminomethyl)-1,3-benzodioxan hydrochloride
TL;DR: trans-6-Chloro-4-(2-fluorophenyl)-2-(2-propylaminomethyl)-1,3-benzodioxan hydrochloride (CAS 65142-65-6) is a chemical compound with molecular formula C18H20Cl2FNO2 and molecular weight 371.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[[(2R,4R)-6-chloro-4-(2-fluorophenyl)-4H-1,3-benzodioxin-2-yl]methyl]propan-2-amine;hydrochloride
Also Known As: trans-6-Chloro-4-(2-fluorophenyl)-2-(2-propylaminomethyl)-1,3-benzodioxan hydrochloride, 4H-1,3-Benzodioxin-2-methanamine, 6-chloro-4-(2-fluorophenyl)-N-(1-methylethyl)-, hydrochloride, trans-, N-[[(2R,4R)-6-chloro-4-(2-fluorophenyl)-4H-1,3-benzodioxin-2-yl]methyl]propan-2-amine hydrochloride, N-{[(2R,4R)-6-Chloro-4-(2-fluorophenyl)-2H,4H-1,3-benzodioxin-2-yl]methyl}propan-2-amine--hydrogen chloride (1/1), RefChem:297004
| Molecular Formula | C18H20Cl2FNO2 |
|---|---|
| Molecular Weight | 371.09 g/mol |
| LogP | 4.7234 |
| Topological Polar Surface Area | 30.49 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 371.0855 |
| Heavy Atoms | 24 |
| Complexity | 696.469 |
Chemical Identifiers
| CAS Number | 65142-65-6 |
|---|---|
| SMILES | CC(C)NC[C@@H]1O[C@H](C2=C(O1)C=CC(=C2)Cl)C3=CC=CC=C3F.Cl |
Product Overview
trans-6-Chloro-4-(2-fluorophenyl)-2-(2-propylaminomethyl)-1,3-benzodioxan hydrochloride (CAS 65142-65-6), with molecular formula C18H20Cl2FNO2 and molecular weight 371.09 g/mol. IUPAC: N-[[(2R,4R)-6-chloro-4-(2-fluorophenyl)-4H-1,3-benzodioxin-2-yl]methyl]propan-2-amine;hydrochloride.
Chemical Property Profile of trans-6-Chloro-4-(2-fluorophenyl)-2-(2-propylaminomethyl)-1,3-benzodioxan hydrochloride
Property Insights of trans-6-Chloro-4-(2-fluorophenyl)-2-(2-propylaminomethyl)-1,3-benzodioxan hydrochloride
The XLogP value of 4.7234 indicates that trans-6-Chloro-4-(2-fluorophenyl)-2-(2-propylaminomethyl)-1,3-benzodioxan hydrochloride is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 30.49 Ų, trans-6-Chloro-4-(2-fluorophenyl)-2-(2-propylaminomethyl)-1,3-benzodioxan hydrochloride exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, trans-6-Chloro-4-(2-fluorophenyl)-2-(2-propylaminomethyl)-1,3-benzodioxan hydrochloride has 1 hydrogen bond donor(s) and 3 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 trans-6-Chloro-4-(2-fluorophenyl)-2-(2-propylaminomethyl)-1,3-benzodioxan hydrochloride?
The CAS number of trans-6-Chloro-4-(2-fluorophenyl)-2-(2-propylaminomethyl)-1,3-benzodioxan hydrochloride is 65142-65-6.
What is the molecular formula of trans-6-Chloro-4-(2-fluorophenyl)-2-(2-propylaminomethyl)-1,3-benzodioxan hydrochloride?
The molecular formula of trans-6-Chloro-4-(2-fluorophenyl)-2-(2-propylaminomethyl)-1,3-benzodioxan hydrochloride is C18H20Cl2FNO2.
What is the molecular weight of trans-6-Chloro-4-(2-fluorophenyl)-2-(2-propylaminomethyl)-1,3-benzodioxan hydrochloride?
The molecular weight of trans-6-Chloro-4-(2-fluorophenyl)-2-(2-propylaminomethyl)-1,3-benzodioxan hydrochloride is 371.09 g/mol.
Where can I buy trans-6-Chloro-4-(2-fluorophenyl)-2-(2-propylaminomethyl)-1,3-benzodioxan hydrochloride?
You can request a quote for trans-6-Chloro-4-(2-fluorophenyl)-2-(2-propylaminomethyl)-1,3-benzodioxan hydrochloride directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for trans-6-Chloro-4-(2-fluorophenyl)-2-(2-propylaminomethyl)-1,3-benzodioxan hydrochloride?
Yes, KEHONG BIO provides custom synthesis services for trans-6-Chloro-4-(2-fluorophenyl)-2-(2-propylaminomethyl)-1,3-benzodioxan hydrochloride and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.