Pyrimidine, 2-((5-nitro-2-thiazolyl)thio)-
TL;DR: Pyrimidine, 2-((5-nitro-2-thiazolyl)thio)- (CAS 40045-67-8) is a chemical compound with molecular formula C7H4N4O2S2 and molecular weight 239.98 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-nitro-2-pyrimidin-2-ylsulfanyl-1,3-thiazole
Also Known As: Pyrimidine, 2-((5-nitro-2-thiazolyl)thio)-, 2-[2-Pyrimidylthio]-5-nitrothiazole, 2-((5-Nitro-2-thiazolyl)thio)pyrimidine, 5-nitro-2-pyrimidin-2-ylsulfanyl-1,3-thiazole, 2-(5-nitro-thiazol-2-ylsulfanyl)-pyrimidine
| Molecular Formula | C7H4N4O2S2 |
|---|---|
| Molecular Weight | 239.98 g/mol |
| LogP | 2.2 |
| Topological Polar Surface Area | 138.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 2 |
| Exact Mass | 239.97757 |
| Heavy Atoms | 15 |
| Complexity | 232.0 |
Chemical Identifiers
| CAS Number | 40045-67-8 |
|---|---|
| SMILES | C1=CN=C(N=C1)SC2=NC=C(S2)[N+](=O)[O-] |
| InChIKey | BQXRJAZCMUNLSR-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Pyrimidine, 2-((5-nitro-2-thiazolyl)thio)- (CAS 40045-67-8), with molecular formula C7H4N4O2S2 and molecular weight 239.98 g/mol. IUPAC: 5-nitro-2-pyrimidin-2-ylsulfanyl-1,3-thiazole.
Chemical Property Profile of Pyrimidine, 2-((5-nitro-2-thiazolyl)thio)-
Property Insights of Pyrimidine, 2-((5-nitro-2-thiazolyl)thio)-
The XLogP value of 2.2 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Pyrimidine, 2-((5-nitro-2-thiazolyl)thio)-. The TPSA of 138.0 Ų falls within the moderate polarity range, balancing permeability and solubility for Pyrimidine, 2-((5-nitro-2-thiazolyl)thio)-. Following Lipinski's Rule of Five, Pyrimidine, 2-((5-nitro-2-thiazolyl)thio)- has 0 hydrogen bond donor(s) and 7 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 Pyrimidine, 2-((5-nitro-2-thiazolyl)thio)-?
The CAS number of Pyrimidine, 2-((5-nitro-2-thiazolyl)thio)- is 40045-67-8.
What is the molecular formula of Pyrimidine, 2-((5-nitro-2-thiazolyl)thio)-?
The molecular formula of Pyrimidine, 2-((5-nitro-2-thiazolyl)thio)- is C7H4N4O2S2.
What is the molecular weight of Pyrimidine, 2-((5-nitro-2-thiazolyl)thio)-?
The molecular weight of Pyrimidine, 2-((5-nitro-2-thiazolyl)thio)- is 239.98 g/mol.
Where can I buy Pyrimidine, 2-((5-nitro-2-thiazolyl)thio)-?
You can request a quote for Pyrimidine, 2-((5-nitro-2-thiazolyl)thio)- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Pyrimidine, 2-((5-nitro-2-thiazolyl)thio)-?
Yes, KEHONG BIO provides custom synthesis services for Pyrimidine, 2-((5-nitro-2-thiazolyl)thio)- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.