1-(4-Hydroxy-1,3-thiazol-2-yl)-3,3-dimethylbutan-2-one
TL;DR: 1-(4-Hydroxy-1,3-thiazol-2-yl)-3,3-dimethylbutan-2-one (CAS 320424-47-3) is a chemical compound with molecular formula C9H13NO2S and molecular weight 199.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(4-hydroxy-1,3-thiazol-2-yl)-3,3-dimethylbutan-2-one
Also Known As: 1-(4-hydroxy-1,3-thiazol-2-yl)-3,3-dimethylbutan-2-one, Bionet2_001678, 1-(4-hydroxy-1,3-thiazol-2-yl)-3,3-dimethyl-2-butanone, 108-173-5, RefChem:425647
| Molecular Formula | C9H13NO2S |
|---|---|
| Molecular Weight | 199.07 g/mol |
| LogP | 2.0064 |
| Topological Polar Surface Area | 50.19 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 199.0667 |
| Heavy Atoms | 13 |
| Complexity | 311.65976 |
Chemical Identifiers
| CAS Number | 320424-47-3 |
|---|---|
| SMILES | CC(C)(C)C(=O)CC1=NC(=CS1)O |
Product Overview
1-(4-Hydroxy-1,3-thiazol-2-yl)-3,3-dimethylbutan-2-one (CAS 320424-47-3), with molecular formula C9H13NO2S and molecular weight 199.07 g/mol. IUPAC: 1-(4-hydroxy-1,3-thiazol-2-yl)-3,3-dimethylbutan-2-one.
Chemical Property Profile of 1-(4-Hydroxy-1,3-thiazol-2-yl)-3,3-dimethylbutan-2-one
Property Insights of 1-(4-Hydroxy-1,3-thiazol-2-yl)-3,3-dimethylbutan-2-one
The XLogP value of 2.0064 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-(4-Hydroxy-1,3-thiazol-2-yl)-3,3-dimethylbutan-2-one. With a topological polar surface area (TPSA) of 50.19 Ų, 1-(4-Hydroxy-1,3-thiazol-2-yl)-3,3-dimethylbutan-2-one exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-(4-Hydroxy-1,3-thiazol-2-yl)-3,3-dimethylbutan-2-one 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 1-(4-Hydroxy-1,3-thiazol-2-yl)-3,3-dimethylbutan-2-one?
The CAS number of 1-(4-Hydroxy-1,3-thiazol-2-yl)-3,3-dimethylbutan-2-one is 320424-47-3.
What is the molecular formula of 1-(4-Hydroxy-1,3-thiazol-2-yl)-3,3-dimethylbutan-2-one?
The molecular formula of 1-(4-Hydroxy-1,3-thiazol-2-yl)-3,3-dimethylbutan-2-one is C9H13NO2S.
What is the molecular weight of 1-(4-Hydroxy-1,3-thiazol-2-yl)-3,3-dimethylbutan-2-one?
The molecular weight of 1-(4-Hydroxy-1,3-thiazol-2-yl)-3,3-dimethylbutan-2-one is 199.07 g/mol.
Where can I buy 1-(4-Hydroxy-1,3-thiazol-2-yl)-3,3-dimethylbutan-2-one?
You can request a quote for 1-(4-Hydroxy-1,3-thiazol-2-yl)-3,3-dimethylbutan-2-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-(4-Hydroxy-1,3-thiazol-2-yl)-3,3-dimethylbutan-2-one?
Yes, KEHONG BIO provides custom synthesis services for 1-(4-Hydroxy-1,3-thiazol-2-yl)-3,3-dimethylbutan-2-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.