2,5-diamino-6-chloro-3-methylpyrimidin-4(3H)-one
TL;DR: 2,5-diamino-6-chloro-3-methylpyrimidin-4(3H)-one (CAS 875-42-3) is a chemical compound with molecular formula C5H7ClN4O and molecular weight 174.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2,5-diamino-6-chloro-3-methylpyrimidin-4-one
Also Known As: 2,5-diamino-6-chloro-3-methylpyrimidin-4(3H)-one, 2,5-diamino-6-chloro-3-methylpyrimidin-4-one, AB-323/25048109, 2,5-diamino-6-chloro-3-methyl-3-hydropyrimidin-4-one, 2,5-diamino-6-chloro-3-methyl-3,4-dihydropyrimidin-4-one
| Molecular Formula | C5H7ClN4O |
|---|---|
| Molecular Weight | 174.03 g/mol |
| LogP | -0.4019 |
| Topological Polar Surface Area | 86.93 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 0 |
| Exact Mass | 174.03084 |
| Heavy Atoms | 11 |
| Complexity | 315.82104 |
Chemical Identifiers
| CAS Number | 875-42-3 |
|---|---|
| SMILES | CN1C(=O)C(=C(N=C1N)Cl)N |
Product Overview
2,5-diamino-6-chloro-3-methylpyrimidin-4(3H)-one (CAS 875-42-3), with molecular formula C5H7ClN4O and molecular weight 174.03 g/mol. IUPAC: 2,5-diamino-6-chloro-3-methylpyrimidin-4-one.
Chemical Property Profile of 2,5-diamino-6-chloro-3-methylpyrimidin-4(3H)-one
Property Insights of 2,5-diamino-6-chloro-3-methylpyrimidin-4(3H)-one
The XLogP value of -0.4019 indicates that 2,5-diamino-6-chloro-3-methylpyrimidin-4(3H)-one is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 86.93 Ų falls within the moderate polarity range, balancing permeability and solubility for 2,5-diamino-6-chloro-3-methylpyrimidin-4(3H)-one. Following Lipinski's Rule of Five, 2,5-diamino-6-chloro-3-methylpyrimidin-4(3H)-one 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
Frequently Asked Questions
What is the CAS number of 2,5-diamino-6-chloro-3-methylpyrimidin-4(3H)-one?
The CAS number of 2,5-diamino-6-chloro-3-methylpyrimidin-4(3H)-one is 875-42-3.
What is the molecular formula of 2,5-diamino-6-chloro-3-methylpyrimidin-4(3H)-one?
The molecular formula of 2,5-diamino-6-chloro-3-methylpyrimidin-4(3H)-one is C5H7ClN4O.
What is the molecular weight of 2,5-diamino-6-chloro-3-methylpyrimidin-4(3H)-one?
The molecular weight of 2,5-diamino-6-chloro-3-methylpyrimidin-4(3H)-one is 174.03 g/mol.
Where can I buy 2,5-diamino-6-chloro-3-methylpyrimidin-4(3H)-one?
You can request a quote for 2,5-diamino-6-chloro-3-methylpyrimidin-4(3H)-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2,5-diamino-6-chloro-3-methylpyrimidin-4(3H)-one?
Yes, KEHONG BIO provides custom synthesis services for 2,5-diamino-6-chloro-3-methylpyrimidin-4(3H)-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.