methyl (2S)-1-methanesulfonylpyrrolidine-2-carboxylate
TL;DR: methyl (2S)-1-methanesulfonylpyrrolidine-2-carboxylate (CAS 396131-95-6) is a chemical compound with molecular formula C7H13NO4S and molecular weight 207.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl (2S)-1-methylsulfonylpyrrolidine-2-carboxylate
Also Known As: methyl (2S)-1-methanesulfonylpyrrolidine-2-carboxylate, N-methylsulfonyl-(s)-proline methyl ester, L-Proline, 1-(methylsulfonyl)-, methyl ester, methyl (2S)-1-methylsulfonylpyrrolidine-2-carboxylate, methyl(2S)-1-methanesulfonylpyrrolidine-2-carboxylate
| Molecular Formula | C7H13NO4S |
|---|---|
| Molecular Weight | 207.06 g/mol |
| LogP | -0.4166 |
| Topological Polar Surface Area | 63.68 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 207.05653 |
| Heavy Atoms | 13 |
| Complexity | 297.6144 |
Chemical Identifiers
| CAS Number | 396131-95-6 |
|---|---|
| SMILES | COC(=O)[C@@H]1CCCN1S(=O)(=O)C |
Product Overview
methyl (2S)-1-methanesulfonylpyrrolidine-2-carboxylate (CAS 396131-95-6), with molecular formula C7H13NO4S and molecular weight 207.06 g/mol. IUPAC: methyl (2S)-1-methylsulfonylpyrrolidine-2-carboxylate.
Chemical Property Profile of methyl (2S)-1-methanesulfonylpyrrolidine-2-carboxylate
Property Insights of methyl (2S)-1-methanesulfonylpyrrolidine-2-carboxylate
The XLogP value of -0.4166 indicates that methyl (2S)-1-methanesulfonylpyrrolidine-2-carboxylate is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 63.68 Ų falls within the moderate polarity range, balancing permeability and solubility for methyl (2S)-1-methanesulfonylpyrrolidine-2-carboxylate. Following Lipinski's Rule of Five, methyl (2S)-1-methanesulfonylpyrrolidine-2-carboxylate has 0 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 methyl (2S)-1-methanesulfonylpyrrolidine-2-carboxylate?
The CAS number of methyl (2S)-1-methanesulfonylpyrrolidine-2-carboxylate is 396131-95-6.
What is the molecular formula of methyl (2S)-1-methanesulfonylpyrrolidine-2-carboxylate?
The molecular formula of methyl (2S)-1-methanesulfonylpyrrolidine-2-carboxylate is C7H13NO4S.
What is the molecular weight of methyl (2S)-1-methanesulfonylpyrrolidine-2-carboxylate?
The molecular weight of methyl (2S)-1-methanesulfonylpyrrolidine-2-carboxylate is 207.06 g/mol.
Where can I buy methyl (2S)-1-methanesulfonylpyrrolidine-2-carboxylate?
You can request a quote for methyl (2S)-1-methanesulfonylpyrrolidine-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 (2S)-1-methanesulfonylpyrrolidine-2-carboxylate?
Yes, KEHONG BIO provides custom synthesis services for methyl (2S)-1-methanesulfonylpyrrolidine-2-carboxylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.