2-Chloro-4-aminopyrimidine
TL;DR: 2-Chloro-4-aminopyrimidine (CAS 7461-50-9) is a chemical compound with molecular formula C4H4ClN3 and molecular weight 129.01 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-chloropyrimidin-4-amine
Also Known As: 4-Amino-2-chloropyrimidine, 2-chloropyrimidin-4-amine, 2-Chloro-4-aminopyrimidine, 2-Chloro-pyrimidin-4-ylamine, zlchem 116
| Molecular Formula | C4H4ClN3 |
|---|---|
| Molecular Weight | 129.01 g/mol |
| LogP | 0.8 |
| Topological Polar Surface Area | 51.8 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 0 |
| Exact Mass | 129.00937 |
| Heavy Atoms | 8 |
| Complexity | 77.0 |
Chemical Identifiers
| CAS Number | 7461-50-9 |
|---|---|
| SMILES | C1=CN=C(N=C1N)Cl |
| InChIKey | LPBDZVNGCNTELM-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 5 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
2-Chloro-4-aminopyrimidine (CAS 7461-50-9), with molecular formula C4H4ClN3 and molecular weight 129.01 g/mol. IUPAC: 2-chloropyrimidin-4-amine.
Chemical Property Profile of 2-Chloro-4-aminopyrimidine
Property Insights of 2-Chloro-4-aminopyrimidine
The XLogP value of 0.8 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-Chloro-4-aminopyrimidine. With a topological polar surface area (TPSA) of 51.8 Ų, 2-Chloro-4-aminopyrimidine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-Chloro-4-aminopyrimidine has 1 hydrogen bond donor(s) and 3 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-Chloro-4-aminopyrimidine?
The CAS number of 2-Chloro-4-aminopyrimidine is 7461-50-9.
What is the molecular formula of 2-Chloro-4-aminopyrimidine?
The molecular formula of 2-Chloro-4-aminopyrimidine is C4H4ClN3.
What is the molecular weight of 2-Chloro-4-aminopyrimidine?
The molecular weight of 2-Chloro-4-aminopyrimidine is 129.01 g/mol.
Where can I buy 2-Chloro-4-aminopyrimidine?
You can request a quote for 2-Chloro-4-aminopyrimidine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-Chloro-4-aminopyrimidine?
Yes, KEHONG BIO provides custom synthesis services for 2-Chloro-4-aminopyrimidine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.