5-Chloro-6-(chloromethyl)-1,2,3,4-tetrahydropyrimidine-2,4-dione
TL;DR: 5-Chloro-6-(chloromethyl)-1,2,3,4-tetrahydropyrimidine-2,4-dione (CAS 73742-45-7) is a chemical compound with molecular formula C5H4Cl2N2O2 and molecular weight 193.96 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-chloro-6-(chloromethyl)-1H-pyrimidine-2,4-dione
Also Known As: 5-Chloro-6-(chloromethyl)pyrimidine-2,4(1H,3H)-dione, Tipiracil Impurity A, Tipiracil Impurity 9, 5-chloro-6-chloromethyluracil, 5-chloro-6-(chloromethyl)-1H-pyrimidine-2,4-dione
| Molecular Formula | C5H4Cl2N2O2 |
|---|---|
| Molecular Weight | 193.96 g/mol |
| LogP | 0.4554 |
| Topological Polar Surface Area | 65.72 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 1 |
| Exact Mass | 193.96498 |
| Heavy Atoms | 11 |
| Complexity | 367.48056 |
Chemical Identifiers
| CAS Number | 73742-45-7 |
|---|---|
| SMILES | C(C1=C(C(=O)NC(=O)N1)Cl)Cl |
Product Overview
5-Chloro-6-(chloromethyl)-1,2,3,4-tetrahydropyrimidine-2,4-dione (CAS 73742-45-7), with molecular formula C5H4Cl2N2O2 and molecular weight 193.96 g/mol. IUPAC: 5-chloro-6-(chloromethyl)-1H-pyrimidine-2,4-dione.
Chemical Property Profile of 5-Chloro-6-(chloromethyl)-1,2,3,4-tetrahydropyrimidine-2,4-dione
Property Insights of 5-Chloro-6-(chloromethyl)-1,2,3,4-tetrahydropyrimidine-2,4-dione
The XLogP value of 0.4554 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 5-Chloro-6-(chloromethyl)-1,2,3,4-tetrahydropyrimidine-2,4-dione. The TPSA of 65.72 Ų falls within the moderate polarity range, balancing permeability and solubility for 5-Chloro-6-(chloromethyl)-1,2,3,4-tetrahydropyrimidine-2,4-dione. Following Lipinski's Rule of Five, 5-Chloro-6-(chloromethyl)-1,2,3,4-tetrahydropyrimidine-2,4-dione has 2 hydrogen bond donor(s) and 2 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-Chloro-6-(chloromethyl)-1,2,3,4-tetrahydropyrimidine-2,4-dione?
The CAS number of 5-Chloro-6-(chloromethyl)-1,2,3,4-tetrahydropyrimidine-2,4-dione is 73742-45-7.
What is the molecular formula of 5-Chloro-6-(chloromethyl)-1,2,3,4-tetrahydropyrimidine-2,4-dione?
The molecular formula of 5-Chloro-6-(chloromethyl)-1,2,3,4-tetrahydropyrimidine-2,4-dione is C5H4Cl2N2O2.
What is the molecular weight of 5-Chloro-6-(chloromethyl)-1,2,3,4-tetrahydropyrimidine-2,4-dione?
The molecular weight of 5-Chloro-6-(chloromethyl)-1,2,3,4-tetrahydropyrimidine-2,4-dione is 193.96 g/mol.
Where can I buy 5-Chloro-6-(chloromethyl)-1,2,3,4-tetrahydropyrimidine-2,4-dione?
You can request a quote for 5-Chloro-6-(chloromethyl)-1,2,3,4-tetrahydropyrimidine-2,4-dione directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 5-Chloro-6-(chloromethyl)-1,2,3,4-tetrahydropyrimidine-2,4-dione?
Yes, KEHONG BIO provides custom synthesis services for 5-Chloro-6-(chloromethyl)-1,2,3,4-tetrahydropyrimidine-2,4-dione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.