2-Pyrrolidinone, 1-(2-mercaptoethyl)-
TL;DR: 2-Pyrrolidinone, 1-(2-mercaptoethyl)- (CAS 13839-15-1) is a chemical compound with molecular formula C6H11NOS and molecular weight 145.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(2-sulfanylethyl)pyrrolidin-2-one
Also Known As: 1-(2-Mercaptoethyl)pyrrolidin-2-one, 1-(2-sulfanylethyl)pyrrolidin-2-one, 2-Pyrrolidinone, 1-(2-mercaptoethyl)-, 1-(2-sulfanylethyl)-2-pyrrolidinone, 1-(2-mercaptoethyl)-2-pyrrolidinone
| Molecular Formula | C6H11NOS |
|---|---|
| Molecular Weight | 145.06 g/mol |
| LogP | 0.1 |
| Topological Polar Surface Area | 21.3 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Exact Mass | 145.05614 |
| Heavy Atoms | 9 |
| Complexity | 116.0 |
Chemical Identifiers
| CAS Number | 13839-15-1 |
|---|---|
| SMILES | C1CC(=O)N(C1)CCS |
| InChIKey | JBODMFWMIWWZSF-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 7 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
2-Pyrrolidinone, 1-(2-mercaptoethyl)- (CAS 13839-15-1), with molecular formula C6H11NOS and molecular weight 145.06 g/mol. IUPAC: 1-(2-sulfanylethyl)pyrrolidin-2-one.
Chemical Property Profile of 2-Pyrrolidinone, 1-(2-mercaptoethyl)-
Property Insights of 2-Pyrrolidinone, 1-(2-mercaptoethyl)-
The XLogP value of 0.1 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-Pyrrolidinone, 1-(2-mercaptoethyl)-. With a topological polar surface area (TPSA) of 21.3 Ų, 2-Pyrrolidinone, 1-(2-mercaptoethyl)- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-Pyrrolidinone, 1-(2-mercaptoethyl)- 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-Pyrrolidinone, 1-(2-mercaptoethyl)-?
The CAS number of 2-Pyrrolidinone, 1-(2-mercaptoethyl)- is 13839-15-1.
What is the molecular formula of 2-Pyrrolidinone, 1-(2-mercaptoethyl)-?
The molecular formula of 2-Pyrrolidinone, 1-(2-mercaptoethyl)- is C6H11NOS.
What is the molecular weight of 2-Pyrrolidinone, 1-(2-mercaptoethyl)-?
The molecular weight of 2-Pyrrolidinone, 1-(2-mercaptoethyl)- is 145.06 g/mol.
Where can I buy 2-Pyrrolidinone, 1-(2-mercaptoethyl)-?
You can request a quote for 2-Pyrrolidinone, 1-(2-mercaptoethyl)- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-Pyrrolidinone, 1-(2-mercaptoethyl)-?
Yes, KEHONG BIO provides custom synthesis services for 2-Pyrrolidinone, 1-(2-mercaptoethyl)- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.