2-Nitromethylene-thiazolidine
TL;DR: 2-Nitromethylene-thiazolidine (CAS 94662-60-9) is a chemical compound with molecular formula C4H6N2O2S and molecular weight 146.01 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(nitromethylidene)-1,3-thiazolidine
Also Known As: Ranitidine Impurity 13, 2-(nitromethylidene)-1,3-thiazolidine, Thiazolidine, 2-(nitromethylene)-, 2-Nitromethylenethiazolidine, 2-Nitromethylene-thiazolidine
| Molecular Formula | C4H6N2O2S |
|---|---|
| Molecular Weight | 146.01 g/mol |
| LogP | 0.3984 |
| Topological Polar Surface Area | 55.17 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 1 |
| Exact Mass | 146.015 |
| Heavy Atoms | 9 |
| Complexity | 148.64662 |
Chemical Identifiers
| CAS Number | 94662-60-9 |
|---|---|
| SMILES | C1CSC(=C[N+](=O)[O-])N1 |
Product Overview
2-Nitromethylene-thiazolidine (CAS 94662-60-9), with molecular formula C4H6N2O2S and molecular weight 146.01 g/mol. IUPAC: 2-(nitromethylidene)-1,3-thiazolidine.
Chemical Property Profile of 2-Nitromethylene-thiazolidine
Property Insights of 2-Nitromethylene-thiazolidine
The XLogP value of 0.3984 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-Nitromethylene-thiazolidine. With a topological polar surface area (TPSA) of 55.17 Ų, 2-Nitromethylene-thiazolidine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-Nitromethylene-thiazolidine 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 2-Nitromethylene-thiazolidine?
The CAS number of 2-Nitromethylene-thiazolidine is 94662-60-9.
What is the molecular formula of 2-Nitromethylene-thiazolidine?
The molecular formula of 2-Nitromethylene-thiazolidine is C4H6N2O2S.
What is the molecular weight of 2-Nitromethylene-thiazolidine?
The molecular weight of 2-Nitromethylene-thiazolidine is 146.01 g/mol.
Where can I buy 2-Nitromethylene-thiazolidine?
You can request a quote for 2-Nitromethylene-thiazolidine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-Nitromethylene-thiazolidine?
Yes, KEHONG BIO provides custom synthesis services for 2-Nitromethylene-thiazolidine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.