Acetic acid, ((4-(2-benzothiazolyl)-2-thiazolyl)thio)-
TL;DR: Acetic acid, ((4-(2-benzothiazolyl)-2-thiazolyl)thio)- (CAS 67723-99-3) is a chemical compound with molecular formula C12H8N2O2S3 and molecular weight 307.97 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]acetic acid
Also Known As: Acetic acid, ((4-(2-benzothiazolyl)-2-thiazolyl)thio)-, ((4-(2-Benzothiazolyl)-2-thiazolyl)thio)acetic acid, {[4-(1,3-Benzothiazol-2-yl)-1,3-thiazol-2-yl]sulfanyl}acetic acid, 2-[[4-(1,3-benzothiazol-2-yl)-1,3-thiazol-2-yl]sulfanyl]acetic acid, BRN 0825664
| Molecular Formula | C12H8N2O2S3 |
|---|---|
| Molecular Weight | 307.97 g/mol |
| LogP | 3.5965 |
| Topological Polar Surface Area | 63.08 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 4 |
| Exact Mass | 307.9748 |
| Heavy Atoms | 19 |
| Complexity | 702.24176 |
Chemical Identifiers
| CAS Number | 67723-99-3 |
|---|---|
| SMILES | C1=CC=C2C(=C1)N=C(S2)C3=CSC(=N3)SCC(=O)O |
Product Overview
Acetic acid, ((4-(2-benzothiazolyl)-2-thiazolyl)thio)- (CAS 67723-99-3), with molecular formula C12H8N2O2S3 and molecular weight 307.97 g/mol. IUPAC: 2-[[4-(1,3-benzothiazol-2-yl)-1,3-thiazol-2-yl]sulfanyl]acetic acid.
Chemical Property Profile of Acetic acid, ((4-(2-benzothiazolyl)-2-thiazolyl)thio)-
Property Insights of Acetic acid, ((4-(2-benzothiazolyl)-2-thiazolyl)thio)-
The XLogP value of 3.5965 indicates that Acetic acid, ((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 Acetic acid, ((4-(2-benzothiazolyl)-2-thiazolyl)thio)-. Following Lipinski's Rule of Five, Acetic acid, ((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 Acetic acid, ((4-(2-benzothiazolyl)-2-thiazolyl)thio)-?
The CAS number of Acetic acid, ((4-(2-benzothiazolyl)-2-thiazolyl)thio)- is 67723-99-3.
What is the molecular formula of Acetic acid, ((4-(2-benzothiazolyl)-2-thiazolyl)thio)-?
The molecular formula of Acetic acid, ((4-(2-benzothiazolyl)-2-thiazolyl)thio)- is C12H8N2O2S3.
What is the molecular weight of Acetic acid, ((4-(2-benzothiazolyl)-2-thiazolyl)thio)-?
The molecular weight of Acetic acid, ((4-(2-benzothiazolyl)-2-thiazolyl)thio)- is 307.97 g/mol.
Where can I buy Acetic acid, ((4-(2-benzothiazolyl)-2-thiazolyl)thio)-?
You can request a quote for Acetic acid, ((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 Acetic acid, ((4-(2-benzothiazolyl)-2-thiazolyl)thio)-?
Yes, KEHONG BIO provides custom synthesis services for Acetic acid, ((4-(2-benzothiazolyl)-2-thiazolyl)thio)- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.