1-((5-Sulfanyl-1,3,4-oxadiazol-2-yl)methyl)pyrrolidin-2-one
TL;DR: 1-((5-Sulfanyl-1,3,4-oxadiazol-2-yl)methyl)pyrrolidin-2-one (CAS 160758-18-9) is a chemical compound with molecular formula C7H9N3O2S and molecular weight 199.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-[(2-sulfanylidene-3H-1,3,4-oxadiazol-5-yl)methyl]pyrrolidin-2-one
Also Known As: 1-[(5-sulfanyl-1,3,4-oxadiazol-2-yl)methyl]pyrrolidin-2-one, 1-[(5-mercapto-1,3,4-oxadiazol-2-yl)methyl]pyrrolidin-2-one, 1-((5-Mercapto-1,3,4-oxadiazol-2-yl)methyl)pyrrolidin-2-one, 1-[(2-sulfanylidene-3H-1,3,4-oxadiazol-5-yl)methyl]pyrrolidin-2-one, 1-((5-Sulfanyl-1,3,4-oxadiazol-2-yl)methyl)pyrrolidin-2-one
| Molecular Formula | C7H9N3O2S |
|---|---|
| Molecular Weight | 199.04 g/mol |
| LogP | 0.85459 |
| Topological Polar Surface Area | 62.13 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 199.04155 |
| Heavy Atoms | 13 |
| Complexity | 369.8146 |
Chemical Identifiers
| CAS Number | 160758-18-9 |
|---|---|
| SMILES | C1CC(=O)N(C1)CC2=NNC(=S)O2 |
Product Overview
1-((5-Sulfanyl-1,3,4-oxadiazol-2-yl)methyl)pyrrolidin-2-one (CAS 160758-18-9), with molecular formula C7H9N3O2S and molecular weight 199.04 g/mol. IUPAC: 1-[(2-sulfanylidene-3H-1,3,4-oxadiazol-5-yl)methyl]pyrrolidin-2-one.
Chemical Property Profile of 1-((5-Sulfanyl-1,3,4-oxadiazol-2-yl)methyl)pyrrolidin-2-one
Property Insights of 1-((5-Sulfanyl-1,3,4-oxadiazol-2-yl)methyl)pyrrolidin-2-one
The XLogP value of 0.85459 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-((5-Sulfanyl-1,3,4-oxadiazol-2-yl)methyl)pyrrolidin-2-one. The TPSA of 62.13 Ų falls within the moderate polarity range, balancing permeability and solubility for 1-((5-Sulfanyl-1,3,4-oxadiazol-2-yl)methyl)pyrrolidin-2-one. Following Lipinski's Rule of Five, 1-((5-Sulfanyl-1,3,4-oxadiazol-2-yl)methyl)pyrrolidin-2-one has 1 hydrogen bond donor(s) and 4 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 1-((5-Sulfanyl-1,3,4-oxadiazol-2-yl)methyl)pyrrolidin-2-one?
The CAS number of 1-((5-Sulfanyl-1,3,4-oxadiazol-2-yl)methyl)pyrrolidin-2-one is 160758-18-9.
What is the molecular formula of 1-((5-Sulfanyl-1,3,4-oxadiazol-2-yl)methyl)pyrrolidin-2-one?
The molecular formula of 1-((5-Sulfanyl-1,3,4-oxadiazol-2-yl)methyl)pyrrolidin-2-one is C7H9N3O2S.
What is the molecular weight of 1-((5-Sulfanyl-1,3,4-oxadiazol-2-yl)methyl)pyrrolidin-2-one?
The molecular weight of 1-((5-Sulfanyl-1,3,4-oxadiazol-2-yl)methyl)pyrrolidin-2-one is 199.04 g/mol.
Where can I buy 1-((5-Sulfanyl-1,3,4-oxadiazol-2-yl)methyl)pyrrolidin-2-one?
You can request a quote for 1-((5-Sulfanyl-1,3,4-oxadiazol-2-yl)methyl)pyrrolidin-2-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-((5-Sulfanyl-1,3,4-oxadiazol-2-yl)methyl)pyrrolidin-2-one?
Yes, KEHONG BIO provides custom synthesis services for 1-((5-Sulfanyl-1,3,4-oxadiazol-2-yl)methyl)pyrrolidin-2-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.