3(2H)-Thiazoleacetic acid, 4-methyl-2-thioxo-
TL;DR: 3(2H)-Thiazoleacetic acid, 4-methyl-2-thioxo- (CAS 31090-12-7) is a chemical compound with molecular formula C6H7NO2S2 and molecular weight 188.99 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(4-methyl-2-sulfanylidene-1,3-thiazol-3-yl)acetic acid
Also Known As: Bualta, Busan77, WSCP, 4-METHYL-2-THIOXO-3(2H)-THIAZOLEACETIC ACID, 3(2H)-Thiazoleacetic acid, 4-methyl-2-thioxo-
| Molecular Formula | C6H7NO2S2 |
|---|---|
| Molecular Weight | 188.99 g/mol |
| LogP | 1.67211 |
| Topological Polar Surface Area | 42.23 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 188.99182 |
| Heavy Atoms | 11 |
| Complexity | 325.56842 |
Chemical Identifiers
| CAS Number | 31090-12-7 |
|---|---|
| SMILES | CC1=CSC(=S)N1CC(=O)O |
Product Overview
3(2H)-Thiazoleacetic acid, 4-methyl-2-thioxo- (CAS 31090-12-7), with molecular formula C6H7NO2S2 and molecular weight 188.99 g/mol. IUPAC: 2-(4-methyl-2-sulfanylidene-1,3-thiazol-3-yl)acetic acid.
Chemical Property Profile of 3(2H)-Thiazoleacetic acid, 4-methyl-2-thioxo-
Property Insights of 3(2H)-Thiazoleacetic acid, 4-methyl-2-thioxo-
The XLogP value of 1.67211 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3(2H)-Thiazoleacetic acid, 4-methyl-2-thioxo-. With a topological polar surface area (TPSA) of 42.23 Ų, 3(2H)-Thiazoleacetic acid, 4-methyl-2-thioxo- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3(2H)-Thiazoleacetic acid, 4-methyl-2-thioxo- has 1 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 3(2H)-Thiazoleacetic acid, 4-methyl-2-thioxo-?
The CAS number of 3(2H)-Thiazoleacetic acid, 4-methyl-2-thioxo- is 31090-12-7.
What is the molecular formula of 3(2H)-Thiazoleacetic acid, 4-methyl-2-thioxo-?
The molecular formula of 3(2H)-Thiazoleacetic acid, 4-methyl-2-thioxo- is C6H7NO2S2.
What is the molecular weight of 3(2H)-Thiazoleacetic acid, 4-methyl-2-thioxo-?
The molecular weight of 3(2H)-Thiazoleacetic acid, 4-methyl-2-thioxo- is 188.99 g/mol.
Where can I buy 3(2H)-Thiazoleacetic acid, 4-methyl-2-thioxo-?
You can request a quote for 3(2H)-Thiazoleacetic acid, 4-methyl-2-thioxo- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3(2H)-Thiazoleacetic acid, 4-methyl-2-thioxo-?
Yes, KEHONG BIO provides custom synthesis services for 3(2H)-Thiazoleacetic acid, 4-methyl-2-thioxo- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.