2-(3,3-dimethyl-2-oxobutylidene)-3-methyl-1,3-thiazolidin-4-one
TL;DR: 2-(3,3-dimethyl-2-oxobutylidene)-3-methyl-1,3-thiazolidin-4-one (CAS 735342-66-2) is a chemical compound with molecular formula C10H15NO2S and molecular weight 213.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(2E)-2-(3,3-dimethyl-2-oxobutylidene)-3-methyl-1,3-thiazolidin-4-one
Also Known As: 2-(3,3-dimethyl-2-oxobutylidene)-3-methyl-1,3-thiazolidin-4-one, (2E)-2-(3,3-dimethyl-2-oxobutylidene)-3-methyl-1,3-thiazolidin-4-one, 2-(3,3-Dimethyl-2-oxobutylidene)-3-methyl-4-thiazolidinone
| Molecular Formula | C10H15NO2S |
|---|---|
| Molecular Weight | 213.08 g/mol |
| LogP | 1.6482 |
| Topological Polar Surface Area | 37.38 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 1 |
| Exact Mass | 213.08235 |
| Heavy Atoms | 14 |
| Complexity | 301.73407 |
Chemical Identifiers
| CAS Number | 735342-66-2 |
|---|---|
| SMILES | CC(C)(C)C(=O)/C=C/1\N(C(=O)CS1)C |
Product Overview
2-(3,3-dimethyl-2-oxobutylidene)-3-methyl-1,3-thiazolidin-4-one (CAS 735342-66-2), with molecular formula C10H15NO2S and molecular weight 213.08 g/mol. IUPAC: (2E)-2-(3,3-dimethyl-2-oxobutylidene)-3-methyl-1,3-thiazolidin-4-one.
Chemical Property Profile of 2-(3,3-dimethyl-2-oxobutylidene)-3-methyl-1,3-thiazolidin-4-one
Property Insights of 2-(3,3-dimethyl-2-oxobutylidene)-3-methyl-1,3-thiazolidin-4-one
The XLogP value of 1.6482 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-(3,3-dimethyl-2-oxobutylidene)-3-methyl-1,3-thiazolidin-4-one. With a topological polar surface area (TPSA) of 37.38 Ų, 2-(3,3-dimethyl-2-oxobutylidene)-3-methyl-1,3-thiazolidin-4-one exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-(3,3-dimethyl-2-oxobutylidene)-3-methyl-1,3-thiazolidin-4-one has 0 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 2-(3,3-dimethyl-2-oxobutylidene)-3-methyl-1,3-thiazolidin-4-one?
The CAS number of 2-(3,3-dimethyl-2-oxobutylidene)-3-methyl-1,3-thiazolidin-4-one is 735342-66-2.
What is the molecular formula of 2-(3,3-dimethyl-2-oxobutylidene)-3-methyl-1,3-thiazolidin-4-one?
The molecular formula of 2-(3,3-dimethyl-2-oxobutylidene)-3-methyl-1,3-thiazolidin-4-one is C10H15NO2S.
What is the molecular weight of 2-(3,3-dimethyl-2-oxobutylidene)-3-methyl-1,3-thiazolidin-4-one?
The molecular weight of 2-(3,3-dimethyl-2-oxobutylidene)-3-methyl-1,3-thiazolidin-4-one is 213.08 g/mol.
Where can I buy 2-(3,3-dimethyl-2-oxobutylidene)-3-methyl-1,3-thiazolidin-4-one?
You can request a quote for 2-(3,3-dimethyl-2-oxobutylidene)-3-methyl-1,3-thiazolidin-4-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-(3,3-dimethyl-2-oxobutylidene)-3-methyl-1,3-thiazolidin-4-one?
Yes, KEHONG BIO provides custom synthesis services for 2-(3,3-dimethyl-2-oxobutylidene)-3-methyl-1,3-thiazolidin-4-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.