5-butan-2-yl-4-hydroxy-2-propylsulfanyl-1H-pyrimidin-6-one
TL;DR: 5-butan-2-yl-4-hydroxy-2-propylsulfanyl-1H-pyrimidin-6-one (CAS 5373-28-4) is a chemical compound with molecular formula C11H18N2O2S and molecular weight 242.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-butan-2-yl-4-hydroxy-2-propylsulfanyl-1H-pyrimidin-6-one
Also Known As: 5-butan-2-yl-4-hydroxy-2-propylsulfanyl-1H-pyrimidin-6-one, 5-sec-butyl-6-hydroxy-2-(propylthio)-4(3H)-pyrimidinone, 5-butan-2-yl-6-hydroxy-2-propylsulfanyl-3H-pyrimidin-4-one, 5-(Butan-2-yl)-6-hydroxy-2-(propylsulfanyl)pyrimidin-4(3H)-one
| Molecular Formula | C11H18N2O2S |
|---|---|
| Molecular Weight | 242.11 g/mol |
| LogP | 2.4911 |
| Topological Polar Surface Area | 65.98 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 242.1089 |
| Heavy Atoms | 16 |
| Complexity | 403.4613 |
Chemical Identifiers
| CAS Number | 5373-28-4 |
|---|---|
| SMILES | CCCSC1=NC(=C(C(=O)N1)C(C)CC)O |
Product Overview
5-butan-2-yl-4-hydroxy-2-propylsulfanyl-1H-pyrimidin-6-one (CAS 5373-28-4), with molecular formula C11H18N2O2S and molecular weight 242.11 g/mol. IUPAC: 5-butan-2-yl-4-hydroxy-2-propylsulfanyl-1H-pyrimidin-6-one.
Chemical Property Profile of 5-butan-2-yl-4-hydroxy-2-propylsulfanyl-1H-pyrimidin-6-one
Property Insights of 5-butan-2-yl-4-hydroxy-2-propylsulfanyl-1H-pyrimidin-6-one
The XLogP value of 2.4911 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 5-butan-2-yl-4-hydroxy-2-propylsulfanyl-1H-pyrimidin-6-one. The TPSA of 65.98 Ų falls within the moderate polarity range, balancing permeability and solubility for 5-butan-2-yl-4-hydroxy-2-propylsulfanyl-1H-pyrimidin-6-one. Following Lipinski's Rule of Five, 5-butan-2-yl-4-hydroxy-2-propylsulfanyl-1H-pyrimidin-6-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-butan-2-yl-4-hydroxy-2-propylsulfanyl-1H-pyrimidin-6-one?
The CAS number of 5-butan-2-yl-4-hydroxy-2-propylsulfanyl-1H-pyrimidin-6-one is 5373-28-4.
What is the molecular formula of 5-butan-2-yl-4-hydroxy-2-propylsulfanyl-1H-pyrimidin-6-one?
The molecular formula of 5-butan-2-yl-4-hydroxy-2-propylsulfanyl-1H-pyrimidin-6-one is C11H18N2O2S.
What is the molecular weight of 5-butan-2-yl-4-hydroxy-2-propylsulfanyl-1H-pyrimidin-6-one?
The molecular weight of 5-butan-2-yl-4-hydroxy-2-propylsulfanyl-1H-pyrimidin-6-one is 242.11 g/mol.
Where can I buy 5-butan-2-yl-4-hydroxy-2-propylsulfanyl-1H-pyrimidin-6-one?
You can request a quote for 5-butan-2-yl-4-hydroxy-2-propylsulfanyl-1H-pyrimidin-6-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 5-butan-2-yl-4-hydroxy-2-propylsulfanyl-1H-pyrimidin-6-one?
Yes, KEHONG BIO provides custom synthesis services for 5-butan-2-yl-4-hydroxy-2-propylsulfanyl-1H-pyrimidin-6-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.