5,5'-((2,4-dichlorophenyl)methylene)bis(6-hydroxy-1,3-dimethyl-2-thioxo-2,3-dihydropyrimidin-4(1H)-one)
TL;DR: 5,5'-((2,4-dichlorophenyl)methylene)bis(6-hydroxy-1,3-dimethyl-2-thioxo-2,3-dihydropyrimidin-4(1H)-one) (CAS 843619-79-4) is a chemical compound with molecular formula C19H18Cl2N4O4S2 and molecular weight 500.01 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-[(2,4-dichlorophenyl)-(4-hydroxy-1,3-dimethyl-6-oxo-2-sulfanylidenepyrimidin-5-yl)methyl]-6-hydroxy-1,3-dimethyl-2-sulfanylidenepyrimidin-4-one
Also Known As: 5,5'-((2,4-dichlorophenyl)methylene)bis(6-hydroxy-1,3-dimethyl-2-thioxo-2,3-dihydropyrimidin-4(1H)-one), 5,5'-[(2,4-dichlorophenyl)methanediyl]bis(6-hydroxy-1,3-dimethyl-2-thioxo-2,3-dihydropyrimidin-4(1H)-one), 5-[(2,4-dichlorophenyl)-(4-hydroxy-1,3-dimethyl-6-oxo-2-sulfanylidenepyrimidin-5-yl)methyl]-6-hydroxy-1,3-dimethyl-2-sulfanylidenepyrimidin-4-one
| Molecular Formula | C19H18Cl2N4O4S2 |
|---|---|
| Molecular Weight | 500.01 g/mol |
| LogP | 3.11818 |
| Topological Polar Surface Area | 94.32 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 3 |
| Exact Mass | 500.01465 |
| Heavy Atoms | 31 |
| Complexity | 1384.6758 |
Chemical Identifiers
| CAS Number | 843619-79-4 |
|---|---|
| SMILES | CN1C(=C(C(=O)N(C1=S)C)C(C2=C(C=C(C=C2)Cl)Cl)C3=C(N(C(=S)N(C3=O)C)C)O)O |
Product Overview
5,5'-((2,4-dichlorophenyl)methylene)bis(6-hydroxy-1,3-dimethyl-2-thioxo-2,3-dihydropyrimidin-4(1H)-one) (CAS 843619-79-4), with molecular formula C19H18Cl2N4O4S2 and molecular weight 500.01 g/mol. IUPAC: 5-[(2,4-dichlorophenyl)-(4-hydroxy-1,3-dimethyl-6-oxo-2-sulfanylidenepyrimidin-5-yl)methyl]-6-hydroxy-1,3-dimethyl-2-sulfanylidenepyrimidin-4-one.
Chemical Property Profile of 5,5'-((2,4-dichlorophenyl)methylene)bis(6-hydroxy-1,3-dimethyl-2-thioxo-2,3-dihydropyrimidin-4(1H)-one)
Property Insights of 5,5'-((2,4-dichlorophenyl)methylene)bis(6-hydroxy-1,3-dimethyl-2-thioxo-2,3-dihydropyrimidin-4(1H)-one)
The XLogP value of 3.11818 indicates that 5,5'-((2,4-dichlorophenyl)methylene)bis(6-hydroxy-1,3-dimethyl-2-thioxo-2,3-dihydropyrimidin-4(1H)-one) is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 94.32 Ų falls within the moderate polarity range, balancing permeability and solubility for 5,5'-((2,4-dichlorophenyl)methylene)bis(6-hydroxy-1,3-dimethyl-2-thioxo-2,3-dihydropyrimidin-4(1H)-one). Following Lipinski's Rule of Five, 5,5'-((2,4-dichlorophenyl)methylene)bis(6-hydroxy-1,3-dimethyl-2-thioxo-2,3-dihydropyrimidin-4(1H)-one) has 2 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 5,5'-((2,4-dichlorophenyl)methylene)bis(6-hydroxy-1,3-dimethyl-2-thioxo-2,3-dihydropyrimidin-4(1H)-one)?
The CAS number of 5,5'-((2,4-dichlorophenyl)methylene)bis(6-hydroxy-1,3-dimethyl-2-thioxo-2,3-dihydropyrimidin-4(1H)-one) is 843619-79-4.
What is the molecular formula of 5,5'-((2,4-dichlorophenyl)methylene)bis(6-hydroxy-1,3-dimethyl-2-thioxo-2,3-dihydropyrimidin-4(1H)-one)?
The molecular formula of 5,5'-((2,4-dichlorophenyl)methylene)bis(6-hydroxy-1,3-dimethyl-2-thioxo-2,3-dihydropyrimidin-4(1H)-one) is C19H18Cl2N4O4S2.
What is the molecular weight of 5,5'-((2,4-dichlorophenyl)methylene)bis(6-hydroxy-1,3-dimethyl-2-thioxo-2,3-dihydropyrimidin-4(1H)-one)?
The molecular weight of 5,5'-((2,4-dichlorophenyl)methylene)bis(6-hydroxy-1,3-dimethyl-2-thioxo-2,3-dihydropyrimidin-4(1H)-one) is 500.01 g/mol.
Where can I buy 5,5'-((2,4-dichlorophenyl)methylene)bis(6-hydroxy-1,3-dimethyl-2-thioxo-2,3-dihydropyrimidin-4(1H)-one)?
You can request a quote for 5,5'-((2,4-dichlorophenyl)methylene)bis(6-hydroxy-1,3-dimethyl-2-thioxo-2,3-dihydropyrimidin-4(1H)-one) directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 5,5'-((2,4-dichlorophenyl)methylene)bis(6-hydroxy-1,3-dimethyl-2-thioxo-2,3-dihydropyrimidin-4(1H)-one)?
Yes, KEHONG BIO provides custom synthesis services for 5,5'-((2,4-dichlorophenyl)methylene)bis(6-hydroxy-1,3-dimethyl-2-thioxo-2,3-dihydropyrimidin-4(1H)-one) and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.