5-Chloro-6-(2-hydroxyethylamino)-3-phenylpyrimidin-4-one
TL;DR: 5-Chloro-6-(2-hydroxyethylamino)-3-phenylpyrimidin-4-one (CAS 701953-53-9) is a chemical compound with molecular formula C12H12ClN3O2 and molecular weight 265.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-chloro-6-(2-hydroxyethylamino)-3-phenylpyrimidin-4-one
Also Known As: BAS 08836599, SDCCGMLS-0038115.P002, 5-chloro-6-(2-hydroxyethylamino)-3-phenylpyrimidin-4-one, BRD-K07515542-001-07-5, 5-chloro-6-((2-hydroxyethyl)amino)-3-phenylpyrimidin-4(3H)-one
| Molecular Formula | C12H12ClN3O2 |
|---|---|
| Molecular Weight | 265.06 g/mol |
| LogP | 1.2901 |
| Topological Polar Surface Area | 67.15 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 265.0618 |
| Heavy Atoms | 18 |
| Complexity | 583.6215 |
Chemical Identifiers
| CAS Number | 701953-53-9 |
|---|---|
| SMILES | C1=CC=C(C=C1)N2C=NC(=C(C2=O)Cl)NCCO |
Product Overview
5-Chloro-6-(2-hydroxyethylamino)-3-phenylpyrimidin-4-one (CAS 701953-53-9), with molecular formula C12H12ClN3O2 and molecular weight 265.06 g/mol. IUPAC: 5-chloro-6-(2-hydroxyethylamino)-3-phenylpyrimidin-4-one.
Chemical Property Profile of 5-Chloro-6-(2-hydroxyethylamino)-3-phenylpyrimidin-4-one
Property Insights of 5-Chloro-6-(2-hydroxyethylamino)-3-phenylpyrimidin-4-one
The XLogP value of 1.2901 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 5-Chloro-6-(2-hydroxyethylamino)-3-phenylpyrimidin-4-one. The TPSA of 67.15 Ų falls within the moderate polarity range, balancing permeability and solubility for 5-Chloro-6-(2-hydroxyethylamino)-3-phenylpyrimidin-4-one. Following Lipinski's Rule of Five, 5-Chloro-6-(2-hydroxyethylamino)-3-phenylpyrimidin-4-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 5-Chloro-6-(2-hydroxyethylamino)-3-phenylpyrimidin-4-one?
The CAS number of 5-Chloro-6-(2-hydroxyethylamino)-3-phenylpyrimidin-4-one is 701953-53-9.
What is the molecular formula of 5-Chloro-6-(2-hydroxyethylamino)-3-phenylpyrimidin-4-one?
The molecular formula of 5-Chloro-6-(2-hydroxyethylamino)-3-phenylpyrimidin-4-one is C12H12ClN3O2.
What is the molecular weight of 5-Chloro-6-(2-hydroxyethylamino)-3-phenylpyrimidin-4-one?
The molecular weight of 5-Chloro-6-(2-hydroxyethylamino)-3-phenylpyrimidin-4-one is 265.06 g/mol.
Where can I buy 5-Chloro-6-(2-hydroxyethylamino)-3-phenylpyrimidin-4-one?
You can request a quote for 5-Chloro-6-(2-hydroxyethylamino)-3-phenylpyrimidin-4-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 5-Chloro-6-(2-hydroxyethylamino)-3-phenylpyrimidin-4-one?
Yes, KEHONG BIO provides custom synthesis services for 5-Chloro-6-(2-hydroxyethylamino)-3-phenylpyrimidin-4-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.