2-(1,3-Benzothiazol-2-ylsulfanyl)propanoic acid
TL;DR: 2-(1,3-Benzothiazol-2-ylsulfanyl)propanoic acid (CAS 175278-16-7) is a chemical compound with molecular formula C10H9NO2S2 and molecular weight 239.01 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(1,3-benzothiazol-2-ylsulfanyl)propanoic acid
Also Known As: 2-(1,3-benzothiazol-2-ylsulfanyl)propanoic acid, ChemDiv1_017957, 2- -PROPIONICACID, 2-(benzothiazol-2-ylsulfanyl)propionic acid, 2-(Benzothiazol-2-ylsulfanyl)-propionic acid
| Molecular Formula | C10H9NO2S2 |
|---|---|
| Molecular Weight | 239.01 g/mol |
| LogP | 2.8615 |
| Topological Polar Surface Area | 50.19 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 239.00748 |
| Heavy Atoms | 15 |
| Complexity | 461.88297 |
Chemical Identifiers
| CAS Number | 175278-16-7 |
|---|---|
| SMILES | CC(C(=O)O)SC1=NC2=CC=CC=C2S1 |
Product Overview
2-(1,3-Benzothiazol-2-ylsulfanyl)propanoic acid (CAS 175278-16-7), with molecular formula C10H9NO2S2 and molecular weight 239.01 g/mol. IUPAC: 2-(1,3-benzothiazol-2-ylsulfanyl)propanoic acid.
Chemical Property Profile of 2-(1,3-Benzothiazol-2-ylsulfanyl)propanoic acid
Property Insights of 2-(1,3-Benzothiazol-2-ylsulfanyl)propanoic acid
The XLogP value of 2.8615 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-(1,3-Benzothiazol-2-ylsulfanyl)propanoic acid. With a topological polar surface area (TPSA) of 50.19 Ų, 2-(1,3-Benzothiazol-2-ylsulfanyl)propanoic acid exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-(1,3-Benzothiazol-2-ylsulfanyl)propanoic 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-(1,3-Benzothiazol-2-ylsulfanyl)propanoic acid?
The CAS number of 2-(1,3-Benzothiazol-2-ylsulfanyl)propanoic acid is 175278-16-7.
What is the molecular formula of 2-(1,3-Benzothiazol-2-ylsulfanyl)propanoic acid?
The molecular formula of 2-(1,3-Benzothiazol-2-ylsulfanyl)propanoic acid is C10H9NO2S2.
What is the molecular weight of 2-(1,3-Benzothiazol-2-ylsulfanyl)propanoic acid?
The molecular weight of 2-(1,3-Benzothiazol-2-ylsulfanyl)propanoic acid is 239.01 g/mol.
Where can I buy 2-(1,3-Benzothiazol-2-ylsulfanyl)propanoic acid?
You can request a quote for 2-(1,3-Benzothiazol-2-ylsulfanyl)propanoic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-(1,3-Benzothiazol-2-ylsulfanyl)propanoic acid?
Yes, KEHONG BIO provides custom synthesis services for 2-(1,3-Benzothiazol-2-ylsulfanyl)propanoic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.