4,6-二甲氧基-5-硝基嘧啶
TL;DR: 4,6-二甲氧基-5-硝基嘧啶 (CAS 15846-14-7) is a chemical compound with molecular formula C6H7N3O4 and molecular weight 185.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4,6-二甲氧基-5-硝基嘧啶
4,6-dimethoxy-5-nitropyrimidine
Also Known As: 4,6-Dimethoxy-5-nitropyrimidine, Pyrimidine, 4,6-dimethoxy-5-nitro-, 4,6-dimethoxy-5-nitro-pyrimidine, 5-nitro-4,6-dimethoxypyrimidine, 46-Dimethoxy-5-nitropyrimidine
| Molecular Formula | C6H7N3O4 |
|---|---|
| Molecular Weight | 185.04 g/mol |
| LogP | 0.6 |
| Topological Polar Surface Area | 90.1 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 2 |
| Exact Mass | 185.04366 |
| Heavy Atoms | 13 |
| Complexity | 171.0 |
Chemical Identifiers
| CAS Number | 15846-14-7 |
|---|---|
| SMILES | COC1=C(C(=NC=N1)OC)[N+](=O)[O-] |
| InChIKey | VPNSJECDVDBDTA-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 3 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
4,6-二甲氧基-5-硝基嘧啶 (CAS 15846-14-7), with molecular formula C6H7N3O4 and molecular weight 185.04 g/mol. IUPAC: 4,6-dimethoxy-5-nitropyrimidine.
Chemical Property Profile of 4,6-二甲氧基-5-硝基嘧啶
Property Insights of 4,6-二甲氧基-5-硝基嘧啶
The XLogP value of 0.6 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4,6-二甲氧基-5-硝基嘧啶. The TPSA of 90.1 Ų falls within the moderate polarity range, balancing permeability and solubility for 4,6-二甲氧基-5-硝基嘧啶. Following Lipinski's Rule of Five, 4,6-二甲氧基-5-硝基嘧啶 has 0 hydrogen bond donor(s) and 6 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 4,6-二甲氧基-5-硝基嘧啶?
The CAS number of 4,6-二甲氧基-5-硝基嘧啶 is 15846-14-7.
What is the molecular formula of 4,6-二甲氧基-5-硝基嘧啶?
The molecular formula of 4,6-二甲氧基-5-硝基嘧啶 is C6H7N3O4.
What is the molecular weight of 4,6-二甲氧基-5-硝基嘧啶?
The molecular weight of 4,6-二甲氧基-5-硝基嘧啶 is 185.04 g/mol.
Where can I buy 4,6-二甲氧基-5-硝基嘧啶?
You can request a quote for 4,6-二甲氧基-5-硝基嘧啶 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4,6-二甲氧基-5-硝基嘧啶?
Yes, KEHONG BIO provides custom synthesis services for 4,6-二甲氧基-5-硝基嘧啶 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.