2-(2-Morpholin-4-yl-2-oxoethyl)sulfanylbenzoic acid
TL;DR: 2-(2-Morpholin-4-yl-2-oxoethyl)sulfanylbenzoic acid (CAS 519150-95-9) is a chemical compound with molecular formula C13H15NO4S and molecular weight 281.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(2-morpholin-4-yl-2-oxoethyl)sulfanylbenzoic acid
Also Known As: 2-((2-morpholino-2-oxoethyl)thio)benzoic acid, 2-(2-morpholin-4-yl-2-oxoethyl)sulfanylbenzoic acid, 2-{[2-(4-morpholinyl)-2-oxoethyl]thio}benzoic acid, 2-(2-morpholin-4-yl-2-oxoethylthio)benzoic acid, 2-[(2-keto-2-morpholino-ethyl)thio]benzoic acid
| Molecular Formula | C13H15NO4S |
|---|---|
| Molecular Weight | 281.07 g/mol |
| LogP | 1.3357 |
| Topological Polar Surface Area | 66.84 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 281.07217 |
| Heavy Atoms | 19 |
| Complexity | 471.46594 |
Chemical Identifiers
| CAS Number | 519150-95-9 |
|---|---|
| SMILES | C1COCCN1C(=O)CSC2=CC=CC=C2C(=O)O |
Product Overview
2-(2-Morpholin-4-yl-2-oxoethyl)sulfanylbenzoic acid (CAS 519150-95-9), with molecular formula C13H15NO4S and molecular weight 281.07 g/mol. IUPAC: 2-(2-morpholin-4-yl-2-oxoethyl)sulfanylbenzoic acid.
Chemical Property Profile of 2-(2-Morpholin-4-yl-2-oxoethyl)sulfanylbenzoic acid
Property Insights of 2-(2-Morpholin-4-yl-2-oxoethyl)sulfanylbenzoic acid
The XLogP value of 1.3357 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-(2-Morpholin-4-yl-2-oxoethyl)sulfanylbenzoic acid. The TPSA of 66.84 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-(2-Morpholin-4-yl-2-oxoethyl)sulfanylbenzoic acid. Following Lipinski's Rule of Five, 2-(2-Morpholin-4-yl-2-oxoethyl)sulfanylbenzoic acid 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 2-(2-Morpholin-4-yl-2-oxoethyl)sulfanylbenzoic acid?
The CAS number of 2-(2-Morpholin-4-yl-2-oxoethyl)sulfanylbenzoic acid is 519150-95-9.
What is the molecular formula of 2-(2-Morpholin-4-yl-2-oxoethyl)sulfanylbenzoic acid?
The molecular formula of 2-(2-Morpholin-4-yl-2-oxoethyl)sulfanylbenzoic acid is C13H15NO4S.
What is the molecular weight of 2-(2-Morpholin-4-yl-2-oxoethyl)sulfanylbenzoic acid?
The molecular weight of 2-(2-Morpholin-4-yl-2-oxoethyl)sulfanylbenzoic acid is 281.07 g/mol.
Where can I buy 2-(2-Morpholin-4-yl-2-oxoethyl)sulfanylbenzoic acid?
You can request a quote for 2-(2-Morpholin-4-yl-2-oxoethyl)sulfanylbenzoic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-(2-Morpholin-4-yl-2-oxoethyl)sulfanylbenzoic acid?
Yes, KEHONG BIO provides custom synthesis services for 2-(2-Morpholin-4-yl-2-oxoethyl)sulfanylbenzoic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.