2,4-Dichloro-5-nitropyrimidine
TL;DR: 2,4-Dichloro-5-nitropyrimidine (CAS 447413-31-2) is a chemical compound with molecular formula C4HCl2N3O2 and molecular weight 192.94 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2,4-dichloro-5-nitropyrimidine
Also Known As: 2,4-Dichloro-5-nitropyrimidine, null, 2,4-Dichloro-5-nitro-pyrimidine, zlchem 540, C4HCl2N3O2
| Molecular Formula | C4HCl2N3O2 |
|---|---|
| Molecular Weight | 192.94 g/mol |
| LogP | 2.0 |
| Topological Polar Surface Area | 71.6 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 0 |
| Exact Mass | 192.94458 |
| Heavy Atoms | 11 |
| Complexity | 162.0 |
Chemical Identifiers
| CAS Number | 447413-31-2 |
|---|---|
| SMILES | C1=C(C(=NC(=N1)Cl)Cl)[N+](=O)[O-] |
| InChIKey | INUSQTPGSHFGHM-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 22 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
2,4-Dichloro-5-nitropyrimidine (CAS 447413-31-2), with molecular formula C4HCl2N3O2 and molecular weight 192.94 g/mol. IUPAC: 2,4-dichloro-5-nitropyrimidine.
Chemical Property Profile of 2,4-Dichloro-5-nitropyrimidine
Property Insights of 2,4-Dichloro-5-nitropyrimidine
The XLogP value of 2.0 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2,4-Dichloro-5-nitropyrimidine. The TPSA of 71.6 Ų falls within the moderate polarity range, balancing permeability and solubility for 2,4-Dichloro-5-nitropyrimidine. Following Lipinski's Rule of Five, 2,4-Dichloro-5-nitropyrimidine has 0 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 2,4-Dichloro-5-nitropyrimidine?
The CAS number of 2,4-Dichloro-5-nitropyrimidine is 447413-31-2.
What is the molecular formula of 2,4-Dichloro-5-nitropyrimidine?
The molecular formula of 2,4-Dichloro-5-nitropyrimidine is C4HCl2N3O2.
What is the molecular weight of 2,4-Dichloro-5-nitropyrimidine?
The molecular weight of 2,4-Dichloro-5-nitropyrimidine is 192.94 g/mol.
Where can I buy 2,4-Dichloro-5-nitropyrimidine?
You can request a quote for 2,4-Dichloro-5-nitropyrimidine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2,4-Dichloro-5-nitropyrimidine?
Yes, KEHONG BIO provides custom synthesis services for 2,4-Dichloro-5-nitropyrimidine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.