羧甲司坦
TL;DR: 羧甲司坦 (CAS 6382-93-0) is a chemical compound with molecular formula C5H9NO4S and molecular weight 179.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
羧甲司坦
(2R)-2-amino-3-(carboxymethylsulfanyl)propanoic acid
Also Known As: carbocysteine, Carbocisteine, S-Carboxymethyl-L-cysteine, carbocistein, Rhinathiol
| Molecular Formula | C5H9NO4S |
|---|---|
| Molecular Weight | 179.03 g/mol |
| LogP | -3.1 |
| Topological Polar Surface Area | 126.0 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 5 |
| Exact Mass | 179.02522 |
| Heavy Atoms | 11 |
| Complexity | 161.0 |
| Melting Point | 185-187 |
| Boiling Point | 417.3 |
| Solubility | 1.6g/L |
Chemical Identifiers
| CAS Number | 6382-93-0 |
|---|---|
| SMILES | C([C@@H](C(=O)O)N)SCC(=O)O |
| InChIKey | GBFLZEXEOZUWRN-VKHMYHEASA-N |
Patent-Derived Application Labels
Derived from 19 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
羧甲司坦 (CAS 6382-93-0), with molecular formula C5H9NO4S and molecular weight 179.03 g/mol. IUPAC: (2R)-2-amino-3-(carboxymethylsulfanyl)propanoic acid.
Chemical Property Profile of 羧甲司坦
Property Insights of 羧甲司坦
The XLogP value of -3.1 indicates that 羧甲司坦 is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 126.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 羧甲司坦. Following Lipinski's Rule of Five, 羧甲司坦 has 3 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 羧甲司坦?
The CAS number of 羧甲司坦 is 6382-93-0.
What is the molecular formula of 羧甲司坦?
The molecular formula of 羧甲司坦 is C5H9NO4S.
What is the molecular weight of 羧甲司坦?
The molecular weight of 羧甲司坦 is 179.03 g/mol.
Where can I buy 羧甲司坦?
You can request a quote for 羧甲司坦 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 羧甲司坦?
Yes, KEHONG BIO provides custom synthesis services for 羧甲司坦 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.