1-((2-Hydroxyethoxy)methyl)-6-(phenylselenenyl)thymine
TL;DR: 1-((2-Hydroxyethoxy)methyl)-6-(phenylselenenyl)thymine (CAS 136632-03-6) is a chemical compound with molecular formula C14H16N2O4Se and molecular weight 356.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(2-hydroxyethoxymethyl)-5-methyl-6-phenylselanylpyrimidine-2,4-dione
Also Known As: 6-(Phenylselenenyl) deriv., 1-((2-Hydroxyethoxy)methyl)-6-(phenylselenenyl)thymine, 1-(2-Hydroxyethoxymethyl)-6-phenylselenothymine, 1-[(2-Hydroxyethoxy)methyl]-6-(phenylselenenyl)thymine, 1-<(2-hydroxyethoxy)methyl>-6-(phenylselenenyl)thymine
| Molecular Formula | C14H16N2O4Se |
|---|---|
| Molecular Weight | 356.03 g/mol |
| LogP | -1.53358 |
| Topological Polar Surface Area | 78.9 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 6 |
| Exact Mass | 356.02753 |
| Heavy Atoms | 21 |
| Complexity | 433.0 |
Chemical Identifiers
| CAS Number | 136632-03-6 |
|---|---|
| SMILES | CC1=C(N(C(=O)NC1=O)COCCO)[Se]C2=CC=CC=C2 |
| InChIKey | QBZVMPXGWMPTKG-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 1 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
1-((2-Hydroxyethoxy)methyl)-6-(phenylselenenyl)thymine (CAS 136632-03-6), with molecular formula C14H16N2O4Se and molecular weight 356.03 g/mol. IUPAC: 1-(2-hydroxyethoxymethyl)-5-methyl-6-phenylselanylpyrimidine-2,4-dione.
Chemical Property Profile of 1-((2-Hydroxyethoxy)methyl)-6-(phenylselenenyl)thymine
Property Insights of 1-((2-Hydroxyethoxy)methyl)-6-(phenylselenenyl)thymine
The XLogP value of -1.53358 indicates that 1-((2-Hydroxyethoxy)methyl)-6-(phenylselenenyl)thymine is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 78.9 Ų falls within the moderate polarity range, balancing permeability and solubility for 1-((2-Hydroxyethoxy)methyl)-6-(phenylselenenyl)thymine. Following Lipinski's Rule of Five, 1-((2-Hydroxyethoxy)methyl)-6-(phenylselenenyl)thymine 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 1-((2-Hydroxyethoxy)methyl)-6-(phenylselenenyl)thymine?
The CAS number of 1-((2-Hydroxyethoxy)methyl)-6-(phenylselenenyl)thymine is 136632-03-6.
What is the molecular formula of 1-((2-Hydroxyethoxy)methyl)-6-(phenylselenenyl)thymine?
The molecular formula of 1-((2-Hydroxyethoxy)methyl)-6-(phenylselenenyl)thymine is C14H16N2O4Se.
What is the molecular weight of 1-((2-Hydroxyethoxy)methyl)-6-(phenylselenenyl)thymine?
The molecular weight of 1-((2-Hydroxyethoxy)methyl)-6-(phenylselenenyl)thymine is 356.03 g/mol.
Where can I buy 1-((2-Hydroxyethoxy)methyl)-6-(phenylselenenyl)thymine?
You can request a quote for 1-((2-Hydroxyethoxy)methyl)-6-(phenylselenenyl)thymine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-((2-Hydroxyethoxy)methyl)-6-(phenylselenenyl)thymine?
Yes, KEHONG BIO provides custom synthesis services for 1-((2-Hydroxyethoxy)methyl)-6-(phenylselenenyl)thymine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.