2-(Methylsulfanyl)-5-nonyl-4,6-pyrimidinediol
TL;DR: 2-(Methylsulfanyl)-5-nonyl-4,6-pyrimidinediol (CAS 720673-62-1) is a chemical compound with molecular formula C14H24N2O2S and molecular weight 284.16 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-hydroxy-2-methylsulfanyl-5-nonyl-1H-pyrimidin-6-one
Also Known As: 2-(methylsulfanyl)-5-nonyl-4,6-pyrimidinediol, 4-hydroxy-2-methylsulfanyl-5-nonyl-1H-pyrimidin-6-one, AE-641/00389003
| Molecular Formula | C14H24N2O2S |
|---|---|
| Molecular Weight | 284.16 g/mol |
| LogP | 3.4905 |
| Topological Polar Surface Area | 65.98 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 9 |
| Exact Mass | 284.15585 |
| Heavy Atoms | 19 |
| Complexity | 431.9444 |
Chemical Identifiers
| CAS Number | 720673-62-1 |
|---|---|
| SMILES | CCCCCCCCCC1=C(N=C(NC1=O)SC)O |
Product Overview
2-(Methylsulfanyl)-5-nonyl-4,6-pyrimidinediol (CAS 720673-62-1), with molecular formula C14H24N2O2S and molecular weight 284.16 g/mol. IUPAC: 4-hydroxy-2-methylsulfanyl-5-nonyl-1H-pyrimidin-6-one.
Chemical Property Profile of 2-(Methylsulfanyl)-5-nonyl-4,6-pyrimidinediol
Property Insights of 2-(Methylsulfanyl)-5-nonyl-4,6-pyrimidinediol
The XLogP value of 3.4905 indicates that 2-(Methylsulfanyl)-5-nonyl-4,6-pyrimidinediol is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 65.98 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-(Methylsulfanyl)-5-nonyl-4,6-pyrimidinediol. Following Lipinski's Rule of Five, 2-(Methylsulfanyl)-5-nonyl-4,6-pyrimidinediol 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-(Methylsulfanyl)-5-nonyl-4,6-pyrimidinediol?
The CAS number of 2-(Methylsulfanyl)-5-nonyl-4,6-pyrimidinediol is 720673-62-1.
What is the molecular formula of 2-(Methylsulfanyl)-5-nonyl-4,6-pyrimidinediol?
The molecular formula of 2-(Methylsulfanyl)-5-nonyl-4,6-pyrimidinediol is C14H24N2O2S.
What is the molecular weight of 2-(Methylsulfanyl)-5-nonyl-4,6-pyrimidinediol?
The molecular weight of 2-(Methylsulfanyl)-5-nonyl-4,6-pyrimidinediol is 284.16 g/mol.
Where can I buy 2-(Methylsulfanyl)-5-nonyl-4,6-pyrimidinediol?
You can request a quote for 2-(Methylsulfanyl)-5-nonyl-4,6-pyrimidinediol directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-(Methylsulfanyl)-5-nonyl-4,6-pyrimidinediol?
Yes, KEHONG BIO provides custom synthesis services for 2-(Methylsulfanyl)-5-nonyl-4,6-pyrimidinediol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.