4,5-Diamino-2,6-dichloropyrimidine
TL;DR: 4,5-Diamino-2,6-dichloropyrimidine (CAS 130838-36-7) is a chemical compound with molecular formula C4H4Cl2N4 and molecular weight 177.98131 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
2,6-dichloropyrimidine-4,5-diamine
Also Known As: 2,6-dichloropyrimidine-4,5-diamine, 2,6-DICHLORO-PYRIMIDINE-4,5-DIAMINE, 2,6-dichloro-4,5-Pyrimidinediamine, 4,5-Diamino-2,6-dichloropyrimidine, DICHLOROPYRIMIDINE-4,5-DIAMINE
Application Areas
Top 5 of 2 IPC patent classification(s) from the SureChEMBL global patent database.
Technical Specifications
| Molecular Formula | C4H4Cl2N4 |
| Molecular Weight | 177.98131 g/mol |
| XLogP | 1.1 |
| Topological Polar Surface Area (TPSA) | 77.8 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 0 |
| Exact Mass | 177.98131 Da |
| Heavy Atoms | 10 |
| Complexity | 122.0 |
| SMILES | C1(=C(N=C(N=C1Cl)Cl)N)N |
| InChIKey | VJVAQTIZGIIBCM-UHFFFAOYSA-N |
Chemical Property Profile of 4,5-Diamino-2,6-dichloropyrimidine
Property Insights of 4,5-Diamino-2,6-dichloropyrimidine
The XLogP value of 1.1 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4,5-Diamino-2,6-dichloropyrimidine. The TPSA of 77.8 Ų falls within the moderate polarity range, balancing permeability and solubility for 4,5-Diamino-2,6-dichloropyrimidine. Following Lipinski's Rule of Five, 4,5-Diamino-2,6-dichloropyrimidine has 2 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 4,5-Diamino-2,6-dichloropyrimidine?
The CAS number of 4,5-Diamino-2,6-dichloropyrimidine is 130838-36-7.
What is the molecular formula of 4,5-Diamino-2,6-dichloropyrimidine?
The molecular formula of 4,5-Diamino-2,6-dichloropyrimidine is C4H4Cl2N4.
What is the molecular weight of 4,5-Diamino-2,6-dichloropyrimidine?
The molecular weight of 4,5-Diamino-2,6-dichloropyrimidine is 177.98131 g/mol.
Where can I buy 4,5-Diamino-2,6-dichloropyrimidine?
You can request a quote for 4,5-Diamino-2,6-dichloropyrimidine directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 4,5-Diamino-2,6-dichloropyrimidine?
Yes, CoreyChem provides custom synthesis services for 4,5-Diamino-2,6-dichloropyrimidine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.