4-Thiazoleacetic acid, 2,3-dihydro-2-thioxo-
TL;DR: 4-Thiazoleacetic acid, 2,3-dihydro-2-thioxo- (CAS 36365-79-4) is a chemical compound with molecular formula C5H5NO2S2 and molecular weight 174.98 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(2-sulfanylidene-3H-1,3-thiazol-4-yl)acetic acid
Also Known As: aceticacid, 2-(2-sulfanyl-1,3-thiazol-4-yl)acetic acid, (2-Thioxo-4-thiazolin-4-yl)acetic acid, EINECS 253-001-5, 4-Thiazoleacetic acid, 2,3-dihydro-2-thioxo-
| Molecular Formula | C5H5NO2S2 |
|---|---|
| Molecular Weight | 174.98 g/mol |
| LogP | 1.43279 |
| Topological Polar Surface Area | 53.09 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 174.97617 |
| Heavy Atoms | 10 |
| Complexity | 287.8381 |
Chemical Identifiers
| CAS Number | 36365-79-4 |
|---|---|
| SMILES | C1=C(NC(=S)S1)CC(=O)O |
Product Overview
4-Thiazoleacetic acid, 2,3-dihydro-2-thioxo- (CAS 36365-79-4), with molecular formula C5H5NO2S2 and molecular weight 174.98 g/mol. IUPAC: 2-(2-sulfanylidene-3H-1,3-thiazol-4-yl)acetic acid.
Chemical Property Profile of 4-Thiazoleacetic acid, 2,3-dihydro-2-thioxo-
Property Insights of 4-Thiazoleacetic acid, 2,3-dihydro-2-thioxo-
The XLogP value of 1.43279 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-Thiazoleacetic acid, 2,3-dihydro-2-thioxo-. With a topological polar surface area (TPSA) of 53.09 Ų, 4-Thiazoleacetic acid, 2,3-dihydro-2-thioxo- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4-Thiazoleacetic acid, 2,3-dihydro-2-thioxo- has 2 hydrogen bond donor(s) and 3 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 4-Thiazoleacetic acid, 2,3-dihydro-2-thioxo-?
The CAS number of 4-Thiazoleacetic acid, 2,3-dihydro-2-thioxo- is 36365-79-4.
What is the molecular formula of 4-Thiazoleacetic acid, 2,3-dihydro-2-thioxo-?
The molecular formula of 4-Thiazoleacetic acid, 2,3-dihydro-2-thioxo- is C5H5NO2S2.
What is the molecular weight of 4-Thiazoleacetic acid, 2,3-dihydro-2-thioxo-?
The molecular weight of 4-Thiazoleacetic acid, 2,3-dihydro-2-thioxo- is 174.98 g/mol.
Where can I buy 4-Thiazoleacetic acid, 2,3-dihydro-2-thioxo-?
You can request a quote for 4-Thiazoleacetic acid, 2,3-dihydro-2-thioxo- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-Thiazoleacetic acid, 2,3-dihydro-2-thioxo-?
Yes, KEHONG BIO provides custom synthesis services for 4-Thiazoleacetic acid, 2,3-dihydro-2-thioxo- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.