pyrrolidine-1-carbothioic S-acid
TL;DR: pyrrolidine-1-carbothioic S-acid (CAS 64369-68-2) is a chemical compound with molecular formula C5H9NOS and molecular weight 131.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
pyrrolidine-1-carbothioic S-acid
Also Known As: pyrrolidine-1-carbothioic S-acid, -pyrrolidine-1-carbothioicacid, Pyrrolidine-1-thiocarboxylic acid, (S)-Pyrrolidine-1-carbothioic acid, J1.658.414B
| Molecular Formula | C5H9NOS |
|---|---|
| Molecular Weight | 131.04 g/mol |
| LogP | 1.132 |
| Topological Polar Surface Area | 20.31 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 0 |
| Exact Mass | 131.04048 |
| Heavy Atoms | 8 |
| Complexity | 98.60179 |
Chemical Identifiers
| CAS Number | 64369-68-2 |
|---|---|
| SMILES | C1CCN(C1)C(=O)S |
Product Overview
pyrrolidine-1-carbothioic S-acid (CAS 64369-68-2), with molecular formula C5H9NOS and molecular weight 131.04 g/mol. IUPAC: pyrrolidine-1-carbothioic S-acid.
Chemical Property Profile of pyrrolidine-1-carbothioic S-acid
Property Insights of pyrrolidine-1-carbothioic S-acid
The XLogP value of 1.132 suggests moderate lipophilicity, balancing water solubility and membrane permeability for pyrrolidine-1-carbothioic S-acid. With a topological polar surface area (TPSA) of 20.31 Ų, pyrrolidine-1-carbothioic S-acid exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, pyrrolidine-1-carbothioic S-acid has 1 hydrogen bond donor(s) and 1 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 pyrrolidine-1-carbothioic S-acid?
The CAS number of pyrrolidine-1-carbothioic S-acid is 64369-68-2.
What is the molecular formula of pyrrolidine-1-carbothioic S-acid?
The molecular formula of pyrrolidine-1-carbothioic S-acid is C5H9NOS.
What is the molecular weight of pyrrolidine-1-carbothioic S-acid?
The molecular weight of pyrrolidine-1-carbothioic S-acid is 131.04 g/mol.
Where can I buy pyrrolidine-1-carbothioic S-acid?
You can request a quote for pyrrolidine-1-carbothioic S-acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for pyrrolidine-1-carbothioic S-acid?
Yes, KEHONG BIO provides custom synthesis services for pyrrolidine-1-carbothioic S-acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.