RefChem:1091305
TL;DR: RefChem:1091305 (CAS 106086-23-1) is a chemical compound with molecular formula C15H21ClN2O3S and molecular weight 344.09613 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
methyl 4-[(2-phenyl-1,3-thiazolidin-3-ium-4-carbonyl)amino]butanoate chloride
Also Known As: Methyl 2-phenylthiazolidine-4-carbonyl-N-aminobutyrate hydrochloride, 4-(((2-Phenyl-4-thiazolidinyl)carbonyl)amino)butanoic acid methyl ester monohydrochloride, Butanoic acid, 4-(((2-phenyl-4-thiazolidinyl)carbonyl)amino)-, methyl ester, monohydrochloride, 4-[(4-methoxy-4-oxobutyl)carbamoyl]-2-phenyl-1,3-thiazolidin-3-ium chloride, methyl 4-[(2-phenyl-1,3-thiazolidin-3-ium-4-carbonyl)amino]butanoate chloride
Technical Specifications
| Molecular Formula | C15H21ClN2O3S |
| Molecular Weight | 344.09613 g/mol |
| XLogP | -2.56 |
| Topological Polar Surface Area (TPSA) | 97.3 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 7 |
| Exact Mass | 344.09613 Da |
| Heavy Atoms | 22 |
| Complexity | 359.0 |
| SMILES | COC(=O)CCCNC(=O)C1CSC([NH2+]1)C2=CC=CC=C2.[Cl-] |
| InChIKey | XRELFAGRJLWRIF-UHFFFAOYSA-N |
Chemical Property Profile of RefChem:1091305
Property Insights of RefChem:1091305
The XLogP value of -2.56 indicates that RefChem:1091305 is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 97.3 Ų falls within the moderate polarity range, balancing permeability and solubility for RefChem:1091305. Following Lipinski's Rule of Five, RefChem:1091305 has 2 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of RefChem:1091305?
The CAS number of RefChem:1091305 is 106086-23-1.
What is the molecular formula of RefChem:1091305?
The molecular formula of RefChem:1091305 is C15H21ClN2O3S.
What is the molecular weight of RefChem:1091305?
The molecular weight of RefChem:1091305 is 344.09613 g/mol.
Where can I buy RefChem:1091305?
You can request a quote for RefChem:1091305 directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for RefChem:1091305?
Yes, CoreyChem provides custom synthesis services for RefChem:1091305 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.