Methyl 3-(pyrrolidin-1-ylsulfonyl)thiophene-2-carboxylate
TL;DR: Methyl 3-(pyrrolidin-1-ylsulfonyl)thiophene-2-carboxylate (CAS 946743-16-4) is a chemical compound with molecular formula C10H13NO4S2 and molecular weight 275.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl 3-pyrrolidin-1-ylsulfonylthiophene-2-carboxylate
Also Known As: methyl 3-(pyrrolidin-1-ylsulfonyl)thiophene-2-carboxylate, SDCCGMLS-0065771.P001, 2348AF, methyl 3-pyrrolidin-1-ylsulfonylthiophene-2-carboxylate, methyl 3-(pyrrolidine-1-sulfonyl)thiophene-2-carboxylate
| Molecular Formula | C10H13NO4S2 |
|---|---|
| Molecular Weight | 275.03 g/mol |
| LogP | 1.3192 |
| Topological Polar Surface Area | 63.68 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 3 |
| Exact Mass | 275.0286 |
| Heavy Atoms | 17 |
| Complexity | 514.16315 |
Chemical Identifiers
| CAS Number | 946743-16-4 |
|---|---|
| SMILES | COC(=O)C1=C(C=CS1)S(=O)(=O)N2CCCC2 |
Product Overview
Methyl 3-(pyrrolidin-1-ylsulfonyl)thiophene-2-carboxylate (CAS 946743-16-4), with molecular formula C10H13NO4S2 and molecular weight 275.03 g/mol. IUPAC: methyl 3-pyrrolidin-1-ylsulfonylthiophene-2-carboxylate.
Chemical Property Profile of Methyl 3-(pyrrolidin-1-ylsulfonyl)thiophene-2-carboxylate
Property Insights of Methyl 3-(pyrrolidin-1-ylsulfonyl)thiophene-2-carboxylate
The XLogP value of 1.3192 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Methyl 3-(pyrrolidin-1-ylsulfonyl)thiophene-2-carboxylate. The TPSA of 63.68 Ų falls within the moderate polarity range, balancing permeability and solubility for Methyl 3-(pyrrolidin-1-ylsulfonyl)thiophene-2-carboxylate. Following Lipinski's Rule of Five, Methyl 3-(pyrrolidin-1-ylsulfonyl)thiophene-2-carboxylate has 0 hydrogen bond donor(s) and 5 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 Methyl 3-(pyrrolidin-1-ylsulfonyl)thiophene-2-carboxylate?
The CAS number of Methyl 3-(pyrrolidin-1-ylsulfonyl)thiophene-2-carboxylate is 946743-16-4.
What is the molecular formula of Methyl 3-(pyrrolidin-1-ylsulfonyl)thiophene-2-carboxylate?
The molecular formula of Methyl 3-(pyrrolidin-1-ylsulfonyl)thiophene-2-carboxylate is C10H13NO4S2.
What is the molecular weight of Methyl 3-(pyrrolidin-1-ylsulfonyl)thiophene-2-carboxylate?
The molecular weight of Methyl 3-(pyrrolidin-1-ylsulfonyl)thiophene-2-carboxylate is 275.03 g/mol.
Where can I buy Methyl 3-(pyrrolidin-1-ylsulfonyl)thiophene-2-carboxylate?
You can request a quote for Methyl 3-(pyrrolidin-1-ylsulfonyl)thiophene-2-carboxylate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Methyl 3-(pyrrolidin-1-ylsulfonyl)thiophene-2-carboxylate?
Yes, KEHONG BIO provides custom synthesis services for Methyl 3-(pyrrolidin-1-ylsulfonyl)thiophene-2-carboxylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.