![1-[(5-Chloro-1-benzothien-3-yl)methyl]pyrrolidine structure](/static/products/337/337470-91-4.png)
1-[(5-Chloro-1-benzothien-3-yl)methyl]pyrrolidine
TL;DR: 1-[(5-Chloro-1-benzothien-3-yl)methyl]pyrrolidine (CAS 337470-91-4) is a chemical compound with molecular formula C13H14ClNS and molecular weight 251.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-[(5-chloro-1-benzothiophen-3-yl)methyl]pyrrolidine
Also Known As: 1-[(5-chloro-1-benzothien-3-yl)methyl]pyrrolidine, AA-516/25012230, 1-[(5-chloro-1-benzothiophen-3-yl)methyl]pyrrolidine, AA-516/30035055
| Molecular Formula | C13H14ClNS |
|---|---|
| Molecular Weight | 251.05 g/mol |
| LogP | 4.1505 |
| Topological Polar Surface Area | 3.24 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Exact Mass | 251.05354 |
| Heavy Atoms | 16 |
| Complexity | 499.60196 |
Chemical Identifiers
| CAS Number | 337470-91-4 |
|---|---|
| SMILES | C1CCN(C1)CC2=CSC3=C2C=C(C=C3)Cl |
Product Overview
1-[(5-Chloro-1-benzothien-3-yl)methyl]pyrrolidine (CAS 337470-91-4), with molecular formula C13H14ClNS and molecular weight 251.05 g/mol. IUPAC: 1-[(5-chloro-1-benzothiophen-3-yl)methyl]pyrrolidine.
Chemical Property Profile of 1-[(5-Chloro-1-benzothien-3-yl)methyl]pyrrolidine
Property Insights of 1-[(5-Chloro-1-benzothien-3-yl)methyl]pyrrolidine
The XLogP value of 4.1505 indicates that 1-[(5-Chloro-1-benzothien-3-yl)methyl]pyrrolidine is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 3.24 Ų, 1-[(5-Chloro-1-benzothien-3-yl)methyl]pyrrolidine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-[(5-Chloro-1-benzothien-3-yl)methyl]pyrrolidine has 0 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 1-[(5-Chloro-1-benzothien-3-yl)methyl]pyrrolidine?
The CAS number of 1-[(5-Chloro-1-benzothien-3-yl)methyl]pyrrolidine is 337470-91-4.
What is the molecular formula of 1-[(5-Chloro-1-benzothien-3-yl)methyl]pyrrolidine?
The molecular formula of 1-[(5-Chloro-1-benzothien-3-yl)methyl]pyrrolidine is C13H14ClNS.
What is the molecular weight of 1-[(5-Chloro-1-benzothien-3-yl)methyl]pyrrolidine?
The molecular weight of 1-[(5-Chloro-1-benzothien-3-yl)methyl]pyrrolidine is 251.05 g/mol.
Where can I buy 1-[(5-Chloro-1-benzothien-3-yl)methyl]pyrrolidine?
You can request a quote for 1-[(5-Chloro-1-benzothien-3-yl)methyl]pyrrolidine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-[(5-Chloro-1-benzothien-3-yl)methyl]pyrrolidine?
Yes, KEHONG BIO provides custom synthesis services for 1-[(5-Chloro-1-benzothien-3-yl)methyl]pyrrolidine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.