Pyrimidine, 5-nitro-2-(2-pyrimidinylthio)-
TL;DR: Pyrimidine, 5-nitro-2-(2-pyrimidinylthio)- (CAS 75464-91-4) is a chemical compound with molecular formula C8H5N5O2S and molecular weight 235.02 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-nitro-2-pyrimidin-2-ylsulfanylpyrimidine
Also Known As: Pyrimidine, 5-nitro-2-(2-pyrimidinylthio)-, 5-nitro-2-pyrimidin-2-ylsulfanylpyrimidine, 5-Nitro-2-[(pyrimidin-2-yl)sulfanyl]pyrimidine
| Molecular Formula | C8H5N5O2S |
|---|---|
| Molecular Weight | 235.02 g/mol |
| LogP | 1.0 |
| Topological Polar Surface Area | 123.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 2 |
| Exact Mass | 235.0164 |
| Heavy Atoms | 16 |
| Complexity | 235.0 |
Chemical Identifiers
| CAS Number | 75464-91-4 |
|---|---|
| SMILES | C1=CN=C(N=C1)SC2=NC=C(C=N2)[N+](=O)[O-] |
| InChIKey | JUIXGEGLRHJZOE-UHFFFAOYSA-N |
Product Overview
Pyrimidine, 5-nitro-2-(2-pyrimidinylthio)- (CAS 75464-91-4), with molecular formula C8H5N5O2S and molecular weight 235.02 g/mol. IUPAC: 5-nitro-2-pyrimidin-2-ylsulfanylpyrimidine.
Chemical Property Profile of Pyrimidine, 5-nitro-2-(2-pyrimidinylthio)-
Property Insights of Pyrimidine, 5-nitro-2-(2-pyrimidinylthio)-
The XLogP value of 1.0 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Pyrimidine, 5-nitro-2-(2-pyrimidinylthio)-. The TPSA of 123.0 Ų falls within the moderate polarity range, balancing permeability and solubility for Pyrimidine, 5-nitro-2-(2-pyrimidinylthio)-. Following Lipinski's Rule of Five, Pyrimidine, 5-nitro-2-(2-pyrimidinylthio)- 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, 5-nitro-2-(2-pyrimidinylthio)-?
The CAS number of Pyrimidine, 5-nitro-2-(2-pyrimidinylthio)- is 75464-91-4.
What is the molecular formula of Pyrimidine, 5-nitro-2-(2-pyrimidinylthio)-?
The molecular formula of Pyrimidine, 5-nitro-2-(2-pyrimidinylthio)- is C8H5N5O2S.
What is the molecular weight of Pyrimidine, 5-nitro-2-(2-pyrimidinylthio)-?
The molecular weight of Pyrimidine, 5-nitro-2-(2-pyrimidinylthio)- is 235.02 g/mol.
Where can I buy Pyrimidine, 5-nitro-2-(2-pyrimidinylthio)-?
You can request a quote for Pyrimidine, 5-nitro-2-(2-pyrimidinylthio)- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Pyrimidine, 5-nitro-2-(2-pyrimidinylthio)-?
Yes, KEHONG BIO provides custom synthesis services for Pyrimidine, 5-nitro-2-(2-pyrimidinylthio)- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.