3-Methyl-2-(nitromethylidene)-1,3-thiazolidin-4-one
TL;DR: 3-Methyl-2-(nitromethylidene)-1,3-thiazolidin-4-one (CAS 338417-34-8) is a chemical compound with molecular formula C5H6N2O3S and molecular weight 174.01 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-methyl-2-(nitromethylidene)-1,3-thiazolidin-4-one
Also Known As: 3-methyl-2-(nitromethylene)-1,3-thiazolan-4-one, 3-methyl-2-(nitromethylidene)-1,3-thiazolidin-4-one
| Molecular Formula | C5H6N2O3S |
|---|---|
| Molecular Weight | 174.01 g/mol |
| LogP | 0.2672 |
| Topological Polar Surface Area | 63.45 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 1 |
| Exact Mass | 174.00992 |
| Heavy Atoms | 11 |
| Complexity | 237.88203 |
Chemical Identifiers
| CAS Number | 338417-34-8 |
|---|---|
| SMILES | CN1C(=O)CSC1=C[N+](=O)[O-] |
Product Overview
3-Methyl-2-(nitromethylidene)-1,3-thiazolidin-4-one (CAS 338417-34-8), with molecular formula C5H6N2O3S and molecular weight 174.01 g/mol. IUPAC: 3-methyl-2-(nitromethylidene)-1,3-thiazolidin-4-one.
Chemical Property Profile of 3-Methyl-2-(nitromethylidene)-1,3-thiazolidin-4-one
Property Insights of 3-Methyl-2-(nitromethylidene)-1,3-thiazolidin-4-one
The XLogP value of 0.2672 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-Methyl-2-(nitromethylidene)-1,3-thiazolidin-4-one. The TPSA of 63.45 Ų falls within the moderate polarity range, balancing permeability and solubility for 3-Methyl-2-(nitromethylidene)-1,3-thiazolidin-4-one. Following Lipinski's Rule of Five, 3-Methyl-2-(nitromethylidene)-1,3-thiazolidin-4-one has 0 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 3-Methyl-2-(nitromethylidene)-1,3-thiazolidin-4-one?
The CAS number of 3-Methyl-2-(nitromethylidene)-1,3-thiazolidin-4-one is 338417-34-8.
What is the molecular formula of 3-Methyl-2-(nitromethylidene)-1,3-thiazolidin-4-one?
The molecular formula of 3-Methyl-2-(nitromethylidene)-1,3-thiazolidin-4-one is C5H6N2O3S.
What is the molecular weight of 3-Methyl-2-(nitromethylidene)-1,3-thiazolidin-4-one?
The molecular weight of 3-Methyl-2-(nitromethylidene)-1,3-thiazolidin-4-one is 174.01 g/mol.
Where can I buy 3-Methyl-2-(nitromethylidene)-1,3-thiazolidin-4-one?
You can request a quote for 3-Methyl-2-(nitromethylidene)-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 3-Methyl-2-(nitromethylidene)-1,3-thiazolidin-4-one?
Yes, KEHONG BIO provides custom synthesis services for 3-Methyl-2-(nitromethylidene)-1,3-thiazolidin-4-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.