(2R,4S)-氮杂环丁烷-2,4-二甲酸
TL;DR: (2R,4S)-氮杂环丁烷-2,4-二甲酸 (CAS 121050-04-2) is a chemical compound with molecular formula C5H7NO4 and molecular weight 145.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(2R,4S)-氮杂环丁烷-2,4-二甲酸
azetidine-2,4-dicarboxylic acid
Also Known As: t-ada, tADA, Azetidine-2,4-dicarboxylic acid, 2,4-azetidinedicarboxylic acid, cis-Azetidine-2,4-dicarboxylic acid
| Molecular Formula | C5H7NO4 |
|---|---|
| Molecular Weight | 145.04 g/mol |
| LogP | -3.1 |
| Topological Polar Surface Area | 86.6 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 2 |
| Exact Mass | 145.0375 |
| Heavy Atoms | 10 |
| Complexity | 160.0 |
Chemical Identifiers
| CAS Number | 121050-04-2 |
|---|---|
| SMILES | C1C(NC1C(=O)O)C(=O)O |
| InChIKey | JMVIGOFRIJJUAW-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 5 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
(2R,4S)-氮杂环丁烷-2,4-二甲酸 (CAS 121050-04-2), with molecular formula C5H7NO4 and molecular weight 145.04 g/mol. IUPAC: azetidine-2,4-dicarboxylic acid.
Chemical Property Profile of (2R,4S)-氮杂环丁烷-2,4-二甲酸
Property Insights of (2R,4S)-氮杂环丁烷-2,4-二甲酸
The XLogP value of -3.1 indicates that (2R,4S)-氮杂环丁烷-2,4-二甲酸 is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 86.6 Ų falls within the moderate polarity range, balancing permeability and solubility for (2R,4S)-氮杂环丁烷-2,4-二甲酸. Following Lipinski's Rule of Five, (2R,4S)-氮杂环丁烷-2,4-二甲酸 has 3 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 (2R,4S)-氮杂环丁烷-2,4-二甲酸?
The CAS number of (2R,4S)-氮杂环丁烷-2,4-二甲酸 is 121050-04-2.
What is the molecular formula of (2R,4S)-氮杂环丁烷-2,4-二甲酸?
The molecular formula of (2R,4S)-氮杂环丁烷-2,4-二甲酸 is C5H7NO4.
What is the molecular weight of (2R,4S)-氮杂环丁烷-2,4-二甲酸?
The molecular weight of (2R,4S)-氮杂环丁烷-2,4-二甲酸 is 145.04 g/mol.
Where can I buy (2R,4S)-氮杂环丁烷-2,4-二甲酸?
You can request a quote for (2R,4S)-氮杂环丁烷-2,4-二甲酸 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (2R,4S)-氮杂环丁烷-2,4-二甲酸?
Yes, KEHONG BIO provides custom synthesis services for (2R,4S)-氮杂环丁烷-2,4-二甲酸 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.