Propanoic acid, 2-((4-(2-benzothiazolyl)-2-thiazolyl)thio)-
TL;DR: Propanoic acid, 2-((4-(2-benzothiazolyl)-2-thiazolyl)thio)- (CAS 67724-01-0) is a chemical compound with molecular formula C13H10N2O2S3 and molecular weight 321.99 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[[4-(1,3-benzothiazol-2-yl)-1,3-thiazol-2-yl]sulfanyl]propanoic acid
Also Known As: 2-((4-(2-Benzothiazolyl)-2-thiazolyl)thio)propanoic acid, Propanoic acid, 2-((4-(2-benzothiazolyl)-2-thiazolyl)thio)-, 2-[[4-(1,3-benzothiazol-2-yl)-1,3-thiazol-2-yl]sulfanyl]propanoic acid, 2-{[4-(1,3-Benzothiazol-2-yl)-1,3-thiazol-2-yl]sulfanyl}propanoic acid, BRN 0831822
| Molecular Formula | C13H10N2O2S3 |
|---|---|
| Molecular Weight | 321.99 g/mol |
| LogP | 3.985 |
| Topological Polar Surface Area | 63.08 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 4 |
| Exact Mass | 321.99045 |
| Heavy Atoms | 20 |
| Complexity | 732.66534 |
Chemical Identifiers
| CAS Number | 67724-01-0 |
|---|---|
| SMILES | CC(C(=O)O)SC1=NC(=CS1)C2=NC3=CC=CC=C3S2 |
Product Overview
Propanoic acid, 2-((4-(2-benzothiazolyl)-2-thiazolyl)thio)- (CAS 67724-01-0), with molecular formula C13H10N2O2S3 and molecular weight 321.99 g/mol. IUPAC: 2-[[4-(1,3-benzothiazol-2-yl)-1,3-thiazol-2-yl]sulfanyl]propanoic acid.
Chemical Property Profile of Propanoic acid, 2-((4-(2-benzothiazolyl)-2-thiazolyl)thio)-
Property Insights of Propanoic acid, 2-((4-(2-benzothiazolyl)-2-thiazolyl)thio)-
The XLogP value of 3.985 indicates that Propanoic acid, 2-((4-(2-benzothiazolyl)-2-thiazolyl)thio)- is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 63.08 Ų falls within the moderate polarity range, balancing permeability and solubility for Propanoic acid, 2-((4-(2-benzothiazolyl)-2-thiazolyl)thio)-. Following Lipinski's Rule of Five, Propanoic acid, 2-((4-(2-benzothiazolyl)-2-thiazolyl)thio)- has 1 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 Propanoic acid, 2-((4-(2-benzothiazolyl)-2-thiazolyl)thio)-?
The CAS number of Propanoic acid, 2-((4-(2-benzothiazolyl)-2-thiazolyl)thio)- is 67724-01-0.
What is the molecular formula of Propanoic acid, 2-((4-(2-benzothiazolyl)-2-thiazolyl)thio)-?
The molecular formula of Propanoic acid, 2-((4-(2-benzothiazolyl)-2-thiazolyl)thio)- is C13H10N2O2S3.
What is the molecular weight of Propanoic acid, 2-((4-(2-benzothiazolyl)-2-thiazolyl)thio)-?
The molecular weight of Propanoic acid, 2-((4-(2-benzothiazolyl)-2-thiazolyl)thio)- is 321.99 g/mol.
Where can I buy Propanoic acid, 2-((4-(2-benzothiazolyl)-2-thiazolyl)thio)-?
You can request a quote for Propanoic acid, 2-((4-(2-benzothiazolyl)-2-thiazolyl)thio)- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Propanoic acid, 2-((4-(2-benzothiazolyl)-2-thiazolyl)thio)-?
Yes, KEHONG BIO provides custom synthesis services for Propanoic acid, 2-((4-(2-benzothiazolyl)-2-thiazolyl)thio)- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.