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Methyl 1-[(4-ethylphenyl)sulfonyl]prolinate
TL;DR: Methyl 1-[(4-ethylphenyl)sulfonyl]prolinate (CAS 484049-67-4) is a chemical compound with molecular formula C14H19NO4S and molecular weight 297.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl 1-(4-ethylphenyl)sulfonylpyrrolidine-2-carboxylate
Also Known As: methyl 1-[(4-ethylphenyl)sulfonyl]prolinate, methyl 1-(4-ethylphenyl)sulfonylpyrrolidine-2-carboxylate, methyl1-[(4-ethylphenyl)sulfonyl]prolinate, Methyl ((4-ethylphenyl)sulfonyl)-L-prolinate, proline, 1-[(4-ethylphenyl)sulfonyl]-, methyl ester
| Molecular Formula | C14H19NO4S |
|---|---|
| Molecular Weight | 297.10 g/mol |
| LogP | 2.3 |
| Topological Polar Surface Area | 72.1 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 5 |
| Exact Mass | 297.1035 |
| Heavy Atoms | 20 |
| Complexity | 435.0 |
Chemical Identifiers
| CAS Number | 484049-67-4 |
|---|---|
| SMILES | CCC1=CC=C(C=C1)S(=O)(=O)N2CCCC2C(=O)OC |
| InChIKey | DDLULSFNTBUSEU-UHFFFAOYSA-N |
Product Overview
Methyl 1-[(4-ethylphenyl)sulfonyl]prolinate (CAS 484049-67-4), with molecular formula C14H19NO4S and molecular weight 297.10 g/mol. IUPAC: methyl 1-(4-ethylphenyl)sulfonylpyrrolidine-2-carboxylate.
Chemical Property Profile of Methyl 1-[(4-ethylphenyl)sulfonyl]prolinate
Property Insights of Methyl 1-[(4-ethylphenyl)sulfonyl]prolinate
The XLogP value of 2.3 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Methyl 1-[(4-ethylphenyl)sulfonyl]prolinate. The TPSA of 72.1 Ų falls within the moderate polarity range, balancing permeability and solubility for Methyl 1-[(4-ethylphenyl)sulfonyl]prolinate. Following Lipinski's Rule of Five, Methyl 1-[(4-ethylphenyl)sulfonyl]prolinate 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 1-[(4-ethylphenyl)sulfonyl]prolinate?
The CAS number of Methyl 1-[(4-ethylphenyl)sulfonyl]prolinate is 484049-67-4.
What is the molecular formula of Methyl 1-[(4-ethylphenyl)sulfonyl]prolinate?
The molecular formula of Methyl 1-[(4-ethylphenyl)sulfonyl]prolinate is C14H19NO4S.
What is the molecular weight of Methyl 1-[(4-ethylphenyl)sulfonyl]prolinate?
The molecular weight of Methyl 1-[(4-ethylphenyl)sulfonyl]prolinate is 297.10 g/mol.
Where can I buy Methyl 1-[(4-ethylphenyl)sulfonyl]prolinate?
You can request a quote for Methyl 1-[(4-ethylphenyl)sulfonyl]prolinate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Methyl 1-[(4-ethylphenyl)sulfonyl]prolinate?
Yes, KEHONG BIO provides custom synthesis services for Methyl 1-[(4-ethylphenyl)sulfonyl]prolinate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.