2-Propanethione, 1-(2-pyrrolidinylidene)-
TL;DR: 2-Propanethione, 1-(2-pyrrolidinylidene)- (CAS 54031-27-5) is a chemical compound with molecular formula C7H11NS and molecular weight 141.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(1E)-1-pyrrolidin-2-ylidenepropane-2-thione
Also Known As: 1- -2-propanethione, 2-Propanethione, 1-(2-pyrrolidinylidene)-, (1E)-1-pyrrolidin-2-ylidenepropane-2-thione, (1E)-1-(2-Pyrrolidinylidene)-2-propanethione #
| Molecular Formula | C7H11NS |
|---|---|
| Molecular Weight | 141.06 g/mol |
| LogP | 1.6435 |
| Topological Polar Surface Area | 12.03 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 1 |
| Exact Mass | 141.06122 |
| Heavy Atoms | 9 |
| Complexity | 140.99515 |
Chemical Identifiers
| CAS Number | 54031-27-5 |
|---|---|
| SMILES | CC(=S)/C=C/1\CCCN1 |
Product Overview
2-Propanethione, 1-(2-pyrrolidinylidene)- (CAS 54031-27-5), with molecular formula C7H11NS and molecular weight 141.06 g/mol. IUPAC: (1E)-1-pyrrolidin-2-ylidenepropane-2-thione.
Chemical Property Profile of 2-Propanethione, 1-(2-pyrrolidinylidene)-
Property Insights of 2-Propanethione, 1-(2-pyrrolidinylidene)-
The XLogP value of 1.6435 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-Propanethione, 1-(2-pyrrolidinylidene)-. With a topological polar surface area (TPSA) of 12.03 Ų, 2-Propanethione, 1-(2-pyrrolidinylidene)- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-Propanethione, 1-(2-pyrrolidinylidene)- 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-Propanethione, 1-(2-pyrrolidinylidene)-?
The CAS number of 2-Propanethione, 1-(2-pyrrolidinylidene)- is 54031-27-5.
What is the molecular formula of 2-Propanethione, 1-(2-pyrrolidinylidene)-?
The molecular formula of 2-Propanethione, 1-(2-pyrrolidinylidene)- is C7H11NS.
What is the molecular weight of 2-Propanethione, 1-(2-pyrrolidinylidene)-?
The molecular weight of 2-Propanethione, 1-(2-pyrrolidinylidene)- is 141.06 g/mol.
Where can I buy 2-Propanethione, 1-(2-pyrrolidinylidene)-?
You can request a quote for 2-Propanethione, 1-(2-pyrrolidinylidene)- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-Propanethione, 1-(2-pyrrolidinylidene)-?
Yes, KEHONG BIO provides custom synthesis services for 2-Propanethione, 1-(2-pyrrolidinylidene)- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.