6-Chloro-N~4~,N~4~-diethylpyrimidine-2,4-diamine
TL;DR: 6-Chloro-N~4~,N~4~-diethylpyrimidine-2,4-diamine (CAS 116895-09-1) is a chemical compound with molecular formula C8H13ClN4 and molecular weight 200.08287 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
6-chloro-4-N,4-N-diethylpyrimidine-2,4-diamine
Also Known As: 2-Amino-6-chloro-4-(diethylamino)pyrimidine, 6-Chloro-N4,N4-diethylpyrimidine-2,4-diamine, Bionet2_000814, 6-chloro-4-N,4-N-diethylpyrimidine-2,4-diamine, 2,4-Pyrimidinediamine, 6-chloro-N4,N4-diethyl-
Technical Specifications
| Molecular Formula | C8H13ClN4 |
| Molecular Weight | 200.08287 g/mol |
| XLogP | 2.0 |
| Topological Polar Surface Area (TPSA) | 55.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 200.08287 Da |
| Heavy Atoms | 13 |
| Complexity | 151.0 |
| SMILES | CCN(CC)C1=CC(=NC(=N1)N)Cl |
| InChIKey | JZPXSIGRVGTURL-UHFFFAOYSA-N |
Chemical Property Profile of 6-Chloro-N~4~,N~4~-diethylpyrimidine-2,4-diamine
Property Insights of 6-Chloro-N~4~,N~4~-diethylpyrimidine-2,4-diamine
The XLogP value of 2.0 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 6-Chloro-N~4~,N~4~-diethylpyrimidine-2,4-diamine. With a topological polar surface area (TPSA) of 55.0 Ų, 6-Chloro-N~4~,N~4~-diethylpyrimidine-2,4-diamine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 6-Chloro-N~4~,N~4~-diethylpyrimidine-2,4-diamine 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
What is the CAS number of 6-Chloro-N~4~,N~4~-diethylpyrimidine-2,4-diamine?
The CAS number of 6-Chloro-N~4~,N~4~-diethylpyrimidine-2,4-diamine is 116895-09-1.
What is the molecular formula of 6-Chloro-N~4~,N~4~-diethylpyrimidine-2,4-diamine?
The molecular formula of 6-Chloro-N~4~,N~4~-diethylpyrimidine-2,4-diamine is C8H13ClN4.
What is the molecular weight of 6-Chloro-N~4~,N~4~-diethylpyrimidine-2,4-diamine?
The molecular weight of 6-Chloro-N~4~,N~4~-diethylpyrimidine-2,4-diamine is 200.08287 g/mol.
Where can I buy 6-Chloro-N~4~,N~4~-diethylpyrimidine-2,4-diamine?
You can request a quote for 6-Chloro-N~4~,N~4~-diethylpyrimidine-2,4-diamine directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 6-Chloro-N~4~,N~4~-diethylpyrimidine-2,4-diamine?
Yes, CoreyChem provides custom synthesis services for 6-Chloro-N~4~,N~4~-diethylpyrimidine-2,4-diamine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.