Neotropine hydrochloride
TL;DR: Neotropine hydrochloride (CAS 7558-84-1) is a chemical compound with molecular formula C17H26ClNO2S and molecular weight 343.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(diethylamino)ethyl 2-cyclopent-2-en-1-yl-2-thiophen-2-ylacetate;hydrochloride
Also Known As: NEOTROPINE HYDROCHLORIDE, NIOSH/XM7605000, 2-(diethylamino)ethyl 2-cyclopenten-1-yl(2-thienyl)acetate hydrochloride, 2-Thiopheneacetic acid, alpha-(2-(2-(diethylamino)ethyl)-2-cyclopenten-1-yl)-, hydrochloride (1:1), 2-diethylaminoethyl 2-cyclopent-2-en-1-yl-2-thiophen-2-ylacetate hydrochloride
| Molecular Formula | C17H26ClNO2S |
|---|---|
| Molecular Weight | 343.14 g/mol |
| LogP | 4.1047 |
| Topological Polar Surface Area | 29.54 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 8 |
| Exact Mass | 343.13727 |
| Heavy Atoms | 22 |
| Complexity | 457.23383 |
Chemical Identifiers
| CAS Number | 7558-84-1 |
|---|---|
| SMILES | CCN(CC)CCOC(=O)C(C1CCC=C1)C2=CC=CS2.Cl |
Product Overview
Neotropine hydrochloride (CAS 7558-84-1), with molecular formula C17H26ClNO2S and molecular weight 343.14 g/mol. IUPAC: 2-(diethylamino)ethyl 2-cyclopent-2-en-1-yl-2-thiophen-2-ylacetate;hydrochloride.
Chemical Property Profile of Neotropine hydrochloride
Property Insights of Neotropine hydrochloride
The XLogP value of 4.1047 indicates that Neotropine hydrochloride is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 29.54 Ų, Neotropine hydrochloride exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Neotropine hydrochloride has 0 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 Neotropine hydrochloride?
The CAS number of Neotropine hydrochloride is 7558-84-1.
What is the molecular formula of Neotropine hydrochloride?
The molecular formula of Neotropine hydrochloride is C17H26ClNO2S.
What is the molecular weight of Neotropine hydrochloride?
The molecular weight of Neotropine hydrochloride is 343.14 g/mol.
Where can I buy Neotropine hydrochloride?
You can request a quote for Neotropine hydrochloride directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Neotropine hydrochloride?
Yes, KEHONG BIO provides custom synthesis services for Neotropine hydrochloride and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.