5-Isopropyl-1-((2-hydroxyethoxy)methyl)-6-(phenylthio)-2-thiouracil
TL;DR: 5-Isopropyl-1-((2-hydroxyethoxy)methyl)-6-(phenylthio)-2-thiouracil (CAS 137897-88-2) is a chemical compound with molecular formula C16H20N2O3S2 and molecular weight 352.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(2-hydroxyethoxymethyl)-6-phenylsulfanyl-5-propan-2-yl-2-sulfanylidenepyrimidin-4-one
Also Known As: 5-iPrHEPT-S, I-HEPU-S, HEPT deriv., 5-Isopropyl-1-((2-hydroxyethoxy)methyl)-6-(phenylthio)-2-thiouracil, 5-Isopropyl-1-hydroxyethoxymethyl-6-(phenylthio)-2-thiouracil
| Molecular Formula | C16H20N2O3S2 |
|---|---|
| Molecular Weight | 352.09 g/mol |
| LogP | 3.14689 |
| Topological Polar Surface Area | 67.25 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 7 |
| Exact Mass | 352.09152 |
| Heavy Atoms | 23 |
| Complexity | 754.15607 |
Chemical Identifiers
| CAS Number | 137897-88-2 |
|---|---|
| SMILES | CC(C)C1=C(N(C(=S)NC1=O)COCCO)SC2=CC=CC=C2 |
Product Overview
5-Isopropyl-1-((2-hydroxyethoxy)methyl)-6-(phenylthio)-2-thiouracil (CAS 137897-88-2), with molecular formula C16H20N2O3S2 and molecular weight 352.09 g/mol. IUPAC: 1-(2-hydroxyethoxymethyl)-6-phenylsulfanyl-5-propan-2-yl-2-sulfanylidenepyrimidin-4-one.
Chemical Property Profile of 5-Isopropyl-1-((2-hydroxyethoxy)methyl)-6-(phenylthio)-2-thiouracil
Property Insights of 5-Isopropyl-1-((2-hydroxyethoxy)methyl)-6-(phenylthio)-2-thiouracil
The XLogP value of 3.14689 indicates that 5-Isopropyl-1-((2-hydroxyethoxy)methyl)-6-(phenylthio)-2-thiouracil is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 67.25 Ų falls within the moderate polarity range, balancing permeability and solubility for 5-Isopropyl-1-((2-hydroxyethoxy)methyl)-6-(phenylthio)-2-thiouracil. Following Lipinski's Rule of Five, 5-Isopropyl-1-((2-hydroxyethoxy)methyl)-6-(phenylthio)-2-thiouracil has 2 hydrogen bond donor(s) and 5 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-Isopropyl-1-((2-hydroxyethoxy)methyl)-6-(phenylthio)-2-thiouracil?
The CAS number of 5-Isopropyl-1-((2-hydroxyethoxy)methyl)-6-(phenylthio)-2-thiouracil is 137897-88-2.
What is the molecular formula of 5-Isopropyl-1-((2-hydroxyethoxy)methyl)-6-(phenylthio)-2-thiouracil?
The molecular formula of 5-Isopropyl-1-((2-hydroxyethoxy)methyl)-6-(phenylthio)-2-thiouracil is C16H20N2O3S2.
What is the molecular weight of 5-Isopropyl-1-((2-hydroxyethoxy)methyl)-6-(phenylthio)-2-thiouracil?
The molecular weight of 5-Isopropyl-1-((2-hydroxyethoxy)methyl)-6-(phenylthio)-2-thiouracil is 352.09 g/mol.
Where can I buy 5-Isopropyl-1-((2-hydroxyethoxy)methyl)-6-(phenylthio)-2-thiouracil?
You can request a quote for 5-Isopropyl-1-((2-hydroxyethoxy)methyl)-6-(phenylthio)-2-thiouracil directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 5-Isopropyl-1-((2-hydroxyethoxy)methyl)-6-(phenylthio)-2-thiouracil?
Yes, KEHONG BIO provides custom synthesis services for 5-Isopropyl-1-((2-hydroxyethoxy)methyl)-6-(phenylthio)-2-thiouracil and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.