Histapyrrodine Hydrochloride
TL;DR: Histapyrrodine Hydrochloride (CAS 6650-81-3) is a chemical compound with molecular formula C19H25ClN2 and molecular weight 316.17 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-benzyl-N-(2-pyrrolidin-1-ylethyl)aniline;hydrochloride
Also Known As: Histapyrrodine hydrochloride, Allantan, Calcistin, Domistan, Histapyrrodine HCl
| Molecular Formula | C19H25ClN2 |
|---|---|
| Molecular Weight | 316.17 g/mol |
| LogP | 4.2108 |
| Topological Polar Surface Area | 6.5 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 6 |
| Exact Mass | 316.17062 |
| Heavy Atoms | 22 |
| Complexity | 273.0 |
Chemical Identifiers
| CAS Number | 6650-81-3 |
|---|---|
| SMILES | C1CCN(C1)CCN(CC2=CC=CC=C2)C3=CC=CC=C3.Cl |
| InChIKey | HLKYILQQGSUEJS-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 1 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Histapyrrodine Hydrochloride (CAS 6650-81-3), with molecular formula C19H25ClN2 and molecular weight 316.17 g/mol. IUPAC: N-benzyl-N-(2-pyrrolidin-1-ylethyl)aniline;hydrochloride.
Chemical Property Profile of Histapyrrodine Hydrochloride
Property Insights of Histapyrrodine Hydrochloride
The XLogP value of 4.2108 indicates that Histapyrrodine Hydrochloride is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 6.5 Ų, Histapyrrodine Hydrochloride exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Histapyrrodine Hydrochloride has 1 hydrogen bond donor(s) and 2 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 Histapyrrodine Hydrochloride?
The CAS number of Histapyrrodine Hydrochloride is 6650-81-3.
What is the molecular formula of Histapyrrodine Hydrochloride?
The molecular formula of Histapyrrodine Hydrochloride is C19H25ClN2.
What is the molecular weight of Histapyrrodine Hydrochloride?
The molecular weight of Histapyrrodine Hydrochloride is 316.17 g/mol.
Where can I buy Histapyrrodine Hydrochloride?
You can request a quote for Histapyrrodine Hydrochloride directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Histapyrrodine Hydrochloride?
Yes, KEHONG BIO provides custom synthesis services for Histapyrrodine Hydrochloride and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.