Benzoic acid, 2-((2-(4-morpholinyl)ethyl)sulfinyl)-, hydrochloride
TL;DR: Benzoic acid, 2-((2-(4-morpholinyl)ethyl)sulfinyl)-, hydrochloride (CAS 59264-25-4) is a chemical compound with molecular formula C13H18ClNO4S and molecular weight 319.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(2-morpholin-4-ylethylsulfinyl)benzoic acid;hydrochloride
Also Known As: CRL 40047, 2-((2-(4-Morpholinyl)ethyl)sulfinyl)benzoic acid hydrochloride, o-(Morpholinoethylsulphinyl)benzoic acid hydrochloride, Benzoic acid, 2-((2-(4-morpholinyl)ethyl)sulfinyl)-, hydrochloride, 2-(2-morpholin-4-ylethylsulfinyl)benzoic acid hydrochloride
| Molecular Formula | C13H18ClNO4S |
|---|---|
| Molecular Weight | 319.06 g/mol |
| LogP | 1.2464 |
| Topological Polar Surface Area | 66.84 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 319.0645 |
| Heavy Atoms | 20 |
| Complexity | 477.19388 |
Chemical Identifiers
| CAS Number | 59264-25-4 |
|---|---|
| SMILES | C1COCCN1CCS(=O)C2=CC=CC=C2C(=O)O.Cl |
Product Overview
Benzoic acid, 2-((2-(4-morpholinyl)ethyl)sulfinyl)-, hydrochloride (CAS 59264-25-4), with molecular formula C13H18ClNO4S and molecular weight 319.06 g/mol. IUPAC: 2-(2-morpholin-4-ylethylsulfinyl)benzoic acid;hydrochloride.
Chemical Property Profile of Benzoic acid, 2-((2-(4-morpholinyl)ethyl)sulfinyl)-, hydrochloride
Property Insights of Benzoic acid, 2-((2-(4-morpholinyl)ethyl)sulfinyl)-, hydrochloride
The XLogP value of 1.2464 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Benzoic acid, 2-((2-(4-morpholinyl)ethyl)sulfinyl)-, hydrochloride. The TPSA of 66.84 Ų falls within the moderate polarity range, balancing permeability and solubility for Benzoic acid, 2-((2-(4-morpholinyl)ethyl)sulfinyl)-, hydrochloride. Following Lipinski's Rule of Five, Benzoic acid, 2-((2-(4-morpholinyl)ethyl)sulfinyl)-, hydrochloride has 1 hydrogen bond donor(s) and 4 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 Benzoic acid, 2-((2-(4-morpholinyl)ethyl)sulfinyl)-, hydrochloride?
The CAS number of Benzoic acid, 2-((2-(4-morpholinyl)ethyl)sulfinyl)-, hydrochloride is 59264-25-4.
What is the molecular formula of Benzoic acid, 2-((2-(4-morpholinyl)ethyl)sulfinyl)-, hydrochloride?
The molecular formula of Benzoic acid, 2-((2-(4-morpholinyl)ethyl)sulfinyl)-, hydrochloride is C13H18ClNO4S.
What is the molecular weight of Benzoic acid, 2-((2-(4-morpholinyl)ethyl)sulfinyl)-, hydrochloride?
The molecular weight of Benzoic acid, 2-((2-(4-morpholinyl)ethyl)sulfinyl)-, hydrochloride is 319.06 g/mol.
Where can I buy Benzoic acid, 2-((2-(4-morpholinyl)ethyl)sulfinyl)-, hydrochloride?
You can request a quote for Benzoic acid, 2-((2-(4-morpholinyl)ethyl)sulfinyl)-, hydrochloride directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Benzoic acid, 2-((2-(4-morpholinyl)ethyl)sulfinyl)-, hydrochloride?
Yes, KEHONG BIO provides custom synthesis services for Benzoic acid, 2-((2-(4-morpholinyl)ethyl)sulfinyl)-, hydrochloride and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.