6-Chloro-5-(methanesulfonyl)pyrimidine-2,4-diamine
TL;DR: 6-Chloro-5-(methanesulfonyl)pyrimidine-2,4-diamine (CAS 78744-33-9) is a chemical compound with molecular formula C5H7ClN4O2S and molecular weight 222.00 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
6-chloro-5-methylsulfonylpyrimidine-2,4-diamine
Also Known As: 6-chloro-5-methylsulfonylpyrimidine-2,4-diamine, 6-chloro-5-(methylsulfonyl)pyrimidine-2,4-diamine, J1.591.387H, 6-Chloro-5-(methanesulfonyl)pyrimidine-2,4-diamine, 6-chloro-5-methylsulfonyl-pyrimidine-2,4-diamine
| Molecular Formula | C5H7ClN4O2S |
|---|---|
| Molecular Weight | 222.00 g/mol |
| LogP | 0.3 |
| Topological Polar Surface Area | 120.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 1 |
| Exact Mass | 221.99782 |
| Heavy Atoms | 13 |
| Complexity | 277.0 |
Chemical Identifiers
| CAS Number | 78744-33-9 |
|---|---|
| SMILES | CS(=O)(=O)C1=C(N=C(N=C1Cl)N)N |
| InChIKey | RJTOPORKJBWXQW-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
6-Chloro-5-(methanesulfonyl)pyrimidine-2,4-diamine (CAS 78744-33-9), with molecular formula C5H7ClN4O2S and molecular weight 222.00 g/mol. IUPAC: 6-chloro-5-methylsulfonylpyrimidine-2,4-diamine.
Chemical Property Profile of 6-Chloro-5-(methanesulfonyl)pyrimidine-2,4-diamine
Property Insights of 6-Chloro-5-(methanesulfonyl)pyrimidine-2,4-diamine
The XLogP value of 0.3 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 6-Chloro-5-(methanesulfonyl)pyrimidine-2,4-diamine. The TPSA of 120.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 6-Chloro-5-(methanesulfonyl)pyrimidine-2,4-diamine. Following Lipinski's Rule of Five, 6-Chloro-5-(methanesulfonyl)pyrimidine-2,4-diamine has 2 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 6-Chloro-5-(methanesulfonyl)pyrimidine-2,4-diamine?
The CAS number of 6-Chloro-5-(methanesulfonyl)pyrimidine-2,4-diamine is 78744-33-9.
What is the molecular formula of 6-Chloro-5-(methanesulfonyl)pyrimidine-2,4-diamine?
The molecular formula of 6-Chloro-5-(methanesulfonyl)pyrimidine-2,4-diamine is C5H7ClN4O2S.
What is the molecular weight of 6-Chloro-5-(methanesulfonyl)pyrimidine-2,4-diamine?
The molecular weight of 6-Chloro-5-(methanesulfonyl)pyrimidine-2,4-diamine is 222.00 g/mol.
Where can I buy 6-Chloro-5-(methanesulfonyl)pyrimidine-2,4-diamine?
You can request a quote for 6-Chloro-5-(methanesulfonyl)pyrimidine-2,4-diamine 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-(methanesulfonyl)pyrimidine-2,4-diamine?
Yes, KEHONG BIO provides custom synthesis services for 6-Chloro-5-(methanesulfonyl)pyrimidine-2,4-diamine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.