2-(1-Methylimidazol-2-yl)sulfanyl-1-pyrrolidin-1-ylethanone
TL;DR: 2-(1-Methylimidazol-2-yl)sulfanyl-1-pyrrolidin-1-ylethanone (CAS 50970-54-2) is a chemical compound with molecular formula C10H15N3OS and molecular weight 225.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(1-methylimidazol-2-yl)sulfanyl-1-pyrrolidin-1-ylethanone
Also Known As: 2-(1-methylimidazol-2-yl)sulfanyl-1-pyrrolidin-1-ylethanone, 2-(1-methylimidazol-2-ylthio)-1-pyrrolidinylethan-1-one, 2-(1-methylimidazol-2-yl)sulfanyl-1-pyrrolidin-1-yl-ethanone, 2-[(1-methyl-1H-imidazol-2-yl)sulfanyl]-1-(pyrrolidin-1-yl)ethanone
| Molecular Formula | C10H15N3OS |
|---|---|
| Molecular Weight | 225.09 g/mol |
| LogP | 1.1346 |
| Topological Polar Surface Area | 38.13 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 225.09358 |
| Heavy Atoms | 15 |
| Complexity | 344.19162 |
Chemical Identifiers
| CAS Number | 50970-54-2 |
|---|---|
| SMILES | CN1C=CN=C1SCC(=O)N2CCCC2 |
Product Overview
2-(1-Methylimidazol-2-yl)sulfanyl-1-pyrrolidin-1-ylethanone (CAS 50970-54-2), with molecular formula C10H15N3OS and molecular weight 225.09 g/mol. IUPAC: 2-(1-methylimidazol-2-yl)sulfanyl-1-pyrrolidin-1-ylethanone.
Chemical Property Profile of 2-(1-Methylimidazol-2-yl)sulfanyl-1-pyrrolidin-1-ylethanone
Property Insights of 2-(1-Methylimidazol-2-yl)sulfanyl-1-pyrrolidin-1-ylethanone
The XLogP value of 1.1346 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-(1-Methylimidazol-2-yl)sulfanyl-1-pyrrolidin-1-ylethanone. With a topological polar surface area (TPSA) of 38.13 Ų, 2-(1-Methylimidazol-2-yl)sulfanyl-1-pyrrolidin-1-ylethanone exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-(1-Methylimidazol-2-yl)sulfanyl-1-pyrrolidin-1-ylethanone has 0 hydrogen bond donor(s) and 3 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-(1-Methylimidazol-2-yl)sulfanyl-1-pyrrolidin-1-ylethanone?
The CAS number of 2-(1-Methylimidazol-2-yl)sulfanyl-1-pyrrolidin-1-ylethanone is 50970-54-2.
What is the molecular formula of 2-(1-Methylimidazol-2-yl)sulfanyl-1-pyrrolidin-1-ylethanone?
The molecular formula of 2-(1-Methylimidazol-2-yl)sulfanyl-1-pyrrolidin-1-ylethanone is C10H15N3OS.
What is the molecular weight of 2-(1-Methylimidazol-2-yl)sulfanyl-1-pyrrolidin-1-ylethanone?
The molecular weight of 2-(1-Methylimidazol-2-yl)sulfanyl-1-pyrrolidin-1-ylethanone is 225.09 g/mol.
Where can I buy 2-(1-Methylimidazol-2-yl)sulfanyl-1-pyrrolidin-1-ylethanone?
You can request a quote for 2-(1-Methylimidazol-2-yl)sulfanyl-1-pyrrolidin-1-ylethanone directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-(1-Methylimidazol-2-yl)sulfanyl-1-pyrrolidin-1-ylethanone?
Yes, KEHONG BIO provides custom synthesis services for 2-(1-Methylimidazol-2-yl)sulfanyl-1-pyrrolidin-1-ylethanone and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.