Delucemine Hydrochloride
TL;DR: Delucemine Hydrochloride (CAS 186495-99-8) is a chemical compound with molecular formula C16H18ClF2N and molecular weight 297.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3,3-bis(3-fluorophenyl)-N-methylpropan-1-amine;hydrochloride
Also Known As: Delucemine hydrochloride, Delucemine HCl, Delucemine Hydrochloride, Delucemine (hydrochloride), NPS-1506 HCL
| Molecular Formula | C16H18ClF2N |
|---|---|
| Molecular Weight | 297.11 g/mol |
| LogP | 4.128 |
| Topological Polar Surface Area | 12.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 5 |
| Exact Mass | 297.1096 |
| Heavy Atoms | 20 |
| Complexity | 237.0 |
Chemical Identifiers
| CAS Number | 186495-99-8 |
|---|---|
| SMILES | CNCCC(C1=CC(=CC=C1)F)C2=CC(=CC=C2)F.Cl |
| InChIKey | MGNMVYXIKDNAKK-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 1 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Delucemine Hydrochloride (CAS 186495-99-8), with molecular formula C16H18ClF2N and molecular weight 297.11 g/mol. IUPAC: 3,3-bis(3-fluorophenyl)-N-methylpropan-1-amine;hydrochloride.
Chemical Property Profile of Delucemine Hydrochloride
Property Insights of Delucemine Hydrochloride
The XLogP value of 4.128 indicates that Delucemine Hydrochloride is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 12.0 Ų, Delucemine Hydrochloride exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Delucemine Hydrochloride has 2 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 Delucemine Hydrochloride?
The CAS number of Delucemine Hydrochloride is 186495-99-8.
What is the molecular formula of Delucemine Hydrochloride?
The molecular formula of Delucemine Hydrochloride is C16H18ClF2N.
What is the molecular weight of Delucemine Hydrochloride?
The molecular weight of Delucemine Hydrochloride is 297.11 g/mol.
Where can I buy Delucemine Hydrochloride?
You can request a quote for Delucemine Hydrochloride directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Delucemine Hydrochloride?
Yes, KEHONG BIO provides custom synthesis services for Delucemine Hydrochloride and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.