5-Dichloroacetamidouracil
TL;DR: 5-Dichloroacetamidouracil (CAS 31385-10-1) is a chemical compound with molecular formula C6H5Cl2N3O3 and molecular weight 236.97 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2,2-dichloro-N-(2,4-dioxo-1H-pyrimidin-5-yl)acetamide
Also Known As: 5-Dichloroacetamidouracil, 5-beta,beta-DICHLOROACETAMINOURACIL, NCI60_004082, Acetamide, 2,2-dichloro-N-(1,2,3,4-tetrahydro-2,4-dioxo-5-pyrimidinyl)-, 2,2-dichloro-n-(2,4-dioxo-1,2,3,4-tetrahydropyrimidin-5-yl)acetamide
| Molecular Formula | C6H5Cl2N3O3 |
|---|---|
| Molecular Weight | 236.97 g/mol |
| LogP | -0.2 |
| Topological Polar Surface Area | 87.3 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 236.9708 |
| Heavy Atoms | 14 |
| Complexity | 326.0 |
Chemical Identifiers
| CAS Number | 31385-10-1 |
|---|---|
| SMILES | C1=C(C(=O)NC(=O)N1)NC(=O)C(Cl)Cl |
| InChIKey | MQLBSYBWVCZQDB-UHFFFAOYSA-N |
Product Overview
5-Dichloroacetamidouracil (CAS 31385-10-1), with molecular formula C6H5Cl2N3O3 and molecular weight 236.97 g/mol. IUPAC: 2,2-dichloro-N-(2,4-dioxo-1H-pyrimidin-5-yl)acetamide.
Chemical Property Profile of 5-Dichloroacetamidouracil
Property Insights of 5-Dichloroacetamidouracil
The XLogP value of -0.2 indicates that 5-Dichloroacetamidouracil is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 87.3 Ų falls within the moderate polarity range, balancing permeability and solubility for 5-Dichloroacetamidouracil. Following Lipinski's Rule of Five, 5-Dichloroacetamidouracil has 3 hydrogen bond donor(s) and 3 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-Dichloroacetamidouracil?
The CAS number of 5-Dichloroacetamidouracil is 31385-10-1.
What is the molecular formula of 5-Dichloroacetamidouracil?
The molecular formula of 5-Dichloroacetamidouracil is C6H5Cl2N3O3.
What is the molecular weight of 5-Dichloroacetamidouracil?
The molecular weight of 5-Dichloroacetamidouracil is 236.97 g/mol.
Where can I buy 5-Dichloroacetamidouracil?
You can request a quote for 5-Dichloroacetamidouracil directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 5-Dichloroacetamidouracil?
Yes, KEHONG BIO provides custom synthesis services for 5-Dichloroacetamidouracil and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.