6-Chloro-5-methoxy-4-pyrimidinamine
TL;DR: 6-Chloro-5-methoxy-4-pyrimidinamine (CAS 5018-41-7) is a chemical compound with molecular formula C5H6ClN3O and molecular weight 159.02 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
6-chloro-5-methoxypyrimidin-4-amine
Also Known As: 4-Amino-6-chloro-5-methoxypyrimidine, 6-Chloro-5-methoxypyrimidin-4-amine, 4-Amino-5-methoxy-6-chloropyrimidine, 6-Chloro-5-methoxy-4-pyrimidinamine, 4-Pyrimidinamine, 6-chloro-5-methoxy-
| Molecular Formula | C5H6ClN3O |
|---|---|
| Molecular Weight | 159.02 g/mol |
| LogP | 0.8 |
| Topological Polar Surface Area | 61.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 1 |
| Exact Mass | 159.01994 |
| Heavy Atoms | 10 |
| Complexity | 113.0 |
Chemical Identifiers
| CAS Number | 5018-41-7 |
|---|---|
| SMILES | COC1=C(N=CN=C1Cl)N |
| InChIKey | AAJZJNHQPBMCFV-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
6-Chloro-5-methoxy-4-pyrimidinamine (CAS 5018-41-7), with molecular formula C5H6ClN3O and molecular weight 159.02 g/mol. IUPAC: 6-chloro-5-methoxypyrimidin-4-amine.
Chemical Property Profile of 6-Chloro-5-methoxy-4-pyrimidinamine
Property Insights of 6-Chloro-5-methoxy-4-pyrimidinamine
The XLogP value of 0.8 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 6-Chloro-5-methoxy-4-pyrimidinamine. The TPSA of 61.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 6-Chloro-5-methoxy-4-pyrimidinamine. Following Lipinski's Rule of Five, 6-Chloro-5-methoxy-4-pyrimidinamine has 1 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 6-Chloro-5-methoxy-4-pyrimidinamine?
The CAS number of 6-Chloro-5-methoxy-4-pyrimidinamine is 5018-41-7.
What is the molecular formula of 6-Chloro-5-methoxy-4-pyrimidinamine?
The molecular formula of 6-Chloro-5-methoxy-4-pyrimidinamine is C5H6ClN3O.
What is the molecular weight of 6-Chloro-5-methoxy-4-pyrimidinamine?
The molecular weight of 6-Chloro-5-methoxy-4-pyrimidinamine is 159.02 g/mol.
Where can I buy 6-Chloro-5-methoxy-4-pyrimidinamine?
You can request a quote for 6-Chloro-5-methoxy-4-pyrimidinamine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 6-Chloro-5-methoxy-4-pyrimidinamine?
Yes, KEHONG BIO provides custom synthesis services for 6-Chloro-5-methoxy-4-pyrimidinamine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.