2-(3,5-Dinitropyridin-2-yl)sulfanylpyrimidine
TL;DR: 2-(3,5-Dinitropyridin-2-yl)sulfanylpyrimidine (CAS 73768-50-0) is a chemical compound with molecular formula C9H5N5O4S and molecular weight 279.01 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[(3,5-dinitro-2-pyridinyl)sulfanyl]pyrimidine
Also Known As: JJC 217, 2-(3,5-dinitropyridin-2-yl)sulfanylpyrimidine, 2-[(3,5-dinitropyridin-2-yl)sulfanyl]pyrimidine, 2-((3,5-Dinitro-2-pyridinyl)thio)pyrimidine, (3,5-Dinitro-2-pyridinyl)2-pyrimidinyl sulfide
| Molecular Formula | C9H5N5O4S |
|---|---|
| Molecular Weight | 279.01 g/mol |
| LogP | 1.5 |
| Topological Polar Surface Area | 156.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 2 |
| Exact Mass | 279.00623 |
| Heavy Atoms | 19 |
| Complexity | 340.0 |
Chemical Identifiers
| CAS Number | 73768-50-0 |
|---|---|
| SMILES | C1=CN=C(N=C1)SC2=C(C=C(C=N2)[N+](=O)[O-])[N+](=O)[O-] |
| InChIKey | WEKVURHZWGWRJC-UHFFFAOYSA-N |
Product Overview
2-(3,5-Dinitropyridin-2-yl)sulfanylpyrimidine (CAS 73768-50-0), with molecular formula C9H5N5O4S and molecular weight 279.01 g/mol. IUPAC: 2-[(3,5-dinitro-2-pyridinyl)sulfanyl]pyrimidine.
Chemical Property Profile of 2-(3,5-Dinitropyridin-2-yl)sulfanylpyrimidine
Property Insights of 2-(3,5-Dinitropyridin-2-yl)sulfanylpyrimidine
The XLogP value of 1.5 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-(3,5-Dinitropyridin-2-yl)sulfanylpyrimidine. The TPSA of 156.0 Ų indicates high polarity, suggesting 2-(3,5-Dinitropyridin-2-yl)sulfanylpyrimidine may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, 2-(3,5-Dinitropyridin-2-yl)sulfanylpyrimidine has 0 hydrogen bond donor(s) and 8 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-(3,5-Dinitropyridin-2-yl)sulfanylpyrimidine?
The CAS number of 2-(3,5-Dinitropyridin-2-yl)sulfanylpyrimidine is 73768-50-0.
What is the molecular formula of 2-(3,5-Dinitropyridin-2-yl)sulfanylpyrimidine?
The molecular formula of 2-(3,5-Dinitropyridin-2-yl)sulfanylpyrimidine is C9H5N5O4S.
What is the molecular weight of 2-(3,5-Dinitropyridin-2-yl)sulfanylpyrimidine?
The molecular weight of 2-(3,5-Dinitropyridin-2-yl)sulfanylpyrimidine is 279.01 g/mol.
Where can I buy 2-(3,5-Dinitropyridin-2-yl)sulfanylpyrimidine?
You can request a quote for 2-(3,5-Dinitropyridin-2-yl)sulfanylpyrimidine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-(3,5-Dinitropyridin-2-yl)sulfanylpyrimidine?
Yes, KEHONG BIO provides custom synthesis services for 2-(3,5-Dinitropyridin-2-yl)sulfanylpyrimidine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.