3-(4-Methoxy-3-pyrrolidin-1-ylsulfonyl-phenyl)prop-2-enoic acid
TL;DR: 3-(4-Methoxy-3-pyrrolidin-1-ylsulfonyl-phenyl)prop-2-enoic acid (CAS 324779-72-8) is a chemical compound with molecular formula C14H17NO5S and molecular weight 311.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-(4-methoxy-3-pyrrolidin-1-ylsulfonylphenyl)prop-2-enoic acid
Also Known As: BAS 03379644, 3-[4-Methoxy-3-(pyrrolidine-1-sulfonyl)phenyl]prop-2-enoic acid, (2E)-3-[4-Methoxy-3-(pyrrolidin-1-ylsulfonyl)phenyl]acrylic acid, 3-(4-methoxy-3-pyrrolidin-1-ylsulfonyl-phenyl)prop-2-enoic acid, 3-(4-methoxy-3-pyrrolidin-1-ylsulfonylphenyl)prop-2-enoic acid
| Molecular Formula | C14H17NO5S |
|---|---|
| Molecular Weight | 311.08 g/mol |
| LogP | 1.5 |
| Topological Polar Surface Area | 92.3 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 5 |
| Exact Mass | 311.08273 |
| Heavy Atoms | 21 |
| Complexity | 490.0 |
Chemical Identifiers
| CAS Number | 324779-72-8 |
|---|---|
| SMILES | COC1=C(C=C(C=C1)C=CC(=O)O)S(=O)(=O)N2CCCC2 |
| InChIKey | YYPLTSZGZCLXHC-UHFFFAOYSA-N |
Product Overview
3-(4-Methoxy-3-pyrrolidin-1-ylsulfonyl-phenyl)prop-2-enoic acid (CAS 324779-72-8), with molecular formula C14H17NO5S and molecular weight 311.08 g/mol. IUPAC: 3-(4-methoxy-3-pyrrolidin-1-ylsulfonylphenyl)prop-2-enoic acid.
Chemical Property Profile of 3-(4-Methoxy-3-pyrrolidin-1-ylsulfonyl-phenyl)prop-2-enoic acid
Property Insights of 3-(4-Methoxy-3-pyrrolidin-1-ylsulfonyl-phenyl)prop-2-enoic acid
The XLogP value of 1.5 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-(4-Methoxy-3-pyrrolidin-1-ylsulfonyl-phenyl)prop-2-enoic acid. The TPSA of 92.3 Ų falls within the moderate polarity range, balancing permeability and solubility for 3-(4-Methoxy-3-pyrrolidin-1-ylsulfonyl-phenyl)prop-2-enoic acid. Following Lipinski's Rule of Five, 3-(4-Methoxy-3-pyrrolidin-1-ylsulfonyl-phenyl)prop-2-enoic acid has 1 hydrogen bond donor(s) and 6 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 3-(4-Methoxy-3-pyrrolidin-1-ylsulfonyl-phenyl)prop-2-enoic acid?
The CAS number of 3-(4-Methoxy-3-pyrrolidin-1-ylsulfonyl-phenyl)prop-2-enoic acid is 324779-72-8.
What is the molecular formula of 3-(4-Methoxy-3-pyrrolidin-1-ylsulfonyl-phenyl)prop-2-enoic acid?
The molecular formula of 3-(4-Methoxy-3-pyrrolidin-1-ylsulfonyl-phenyl)prop-2-enoic acid is C14H17NO5S.
What is the molecular weight of 3-(4-Methoxy-3-pyrrolidin-1-ylsulfonyl-phenyl)prop-2-enoic acid?
The molecular weight of 3-(4-Methoxy-3-pyrrolidin-1-ylsulfonyl-phenyl)prop-2-enoic acid is 311.08 g/mol.
Where can I buy 3-(4-Methoxy-3-pyrrolidin-1-ylsulfonyl-phenyl)prop-2-enoic acid?
You can request a quote for 3-(4-Methoxy-3-pyrrolidin-1-ylsulfonyl-phenyl)prop-2-enoic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-(4-Methoxy-3-pyrrolidin-1-ylsulfonyl-phenyl)prop-2-enoic acid?
Yes, KEHONG BIO provides custom synthesis services for 3-(4-Methoxy-3-pyrrolidin-1-ylsulfonyl-phenyl)prop-2-enoic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.