2-Hydroxy-2,2-diphenyl-1-(pyrrolidin-1-yl)ethane-1-thione
TL;DR: 2-Hydroxy-2,2-diphenyl-1-(pyrrolidin-1-yl)ethane-1-thione (CAS 59408-56-9) is a chemical compound with molecular formula C18H19NOS and molecular weight 297.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-hydroxy-2,2-diphenyl-1-pyrrolidin-1-ylethanethione
Also Known As: 2-Hydroxy-2,2-diphenyl-1-(pyrrolidin-1-yl)ethane-1-thione, 2-hydroxy-2,2-diphenyl-1-pyrrolidin-1-ylethanethione, 2-Hydroxy-2,2-diphenyl-1-pyrrolidin-1-yl-ethanethione, RefChem:261584
| Molecular Formula | C18H19NOS |
|---|---|
| Molecular Weight | 297.12 g/mol |
| LogP | 3.3 |
| Topological Polar Surface Area | 55.6 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 3 |
| Exact Mass | 297.11874 |
| Heavy Atoms | 21 |
| Complexity | 334.0 |
Chemical Identifiers
| CAS Number | 59408-56-9 |
|---|---|
| SMILES | C1CCN(C1)C(=S)C(C2=CC=CC=C2)(C3=CC=CC=C3)O |
| InChIKey | MOTUVLXXXIPETP-UHFFFAOYSA-N |
Product Overview
2-Hydroxy-2,2-diphenyl-1-(pyrrolidin-1-yl)ethane-1-thione (CAS 59408-56-9), with molecular formula C18H19NOS and molecular weight 297.12 g/mol. IUPAC: 2-hydroxy-2,2-diphenyl-1-pyrrolidin-1-ylethanethione.
Chemical Property Profile of 2-Hydroxy-2,2-diphenyl-1-(pyrrolidin-1-yl)ethane-1-thione
Property Insights of 2-Hydroxy-2,2-diphenyl-1-(pyrrolidin-1-yl)ethane-1-thione
The XLogP value of 3.3 indicates that 2-Hydroxy-2,2-diphenyl-1-(pyrrolidin-1-yl)ethane-1-thione is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 55.6 Ų, 2-Hydroxy-2,2-diphenyl-1-(pyrrolidin-1-yl)ethane-1-thione exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-Hydroxy-2,2-diphenyl-1-(pyrrolidin-1-yl)ethane-1-thione 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 2-Hydroxy-2,2-diphenyl-1-(pyrrolidin-1-yl)ethane-1-thione?
The CAS number of 2-Hydroxy-2,2-diphenyl-1-(pyrrolidin-1-yl)ethane-1-thione is 59408-56-9.
What is the molecular formula of 2-Hydroxy-2,2-diphenyl-1-(pyrrolidin-1-yl)ethane-1-thione?
The molecular formula of 2-Hydroxy-2,2-diphenyl-1-(pyrrolidin-1-yl)ethane-1-thione is C18H19NOS.
What is the molecular weight of 2-Hydroxy-2,2-diphenyl-1-(pyrrolidin-1-yl)ethane-1-thione?
The molecular weight of 2-Hydroxy-2,2-diphenyl-1-(pyrrolidin-1-yl)ethane-1-thione is 297.12 g/mol.
Where can I buy 2-Hydroxy-2,2-diphenyl-1-(pyrrolidin-1-yl)ethane-1-thione?
You can request a quote for 2-Hydroxy-2,2-diphenyl-1-(pyrrolidin-1-yl)ethane-1-thione directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-Hydroxy-2,2-diphenyl-1-(pyrrolidin-1-yl)ethane-1-thione?
Yes, KEHONG BIO provides custom synthesis services for 2-Hydroxy-2,2-diphenyl-1-(pyrrolidin-1-yl)ethane-1-thione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.