N-(5-Amino-2,4,6-trioxohexahydropyrimidin-5-yl)urea
TL;DR: N-(5-Amino-2,4,6-trioxohexahydropyrimidin-5-yl)urea (CAS 85066-70-2) is a chemical compound with molecular formula C5H7N5O4 and molecular weight 201.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(5-amino-2,4,6-trioxo-1,3-diazinan-5-yl)urea
Also Known As: (5-amino-2,4,6-trioxo-1,3-diazinan-5-yl)urea, N-(5-Amino-2,4,6-trioxohexahydropyrimidin-5-yl)urea, 5-amino-5-ureido-2,4,6(1H,3H,5H)-pyrimidinetrione, N-(5-Amino-2,4,6-trioxo-1,3-diazinan-5-yl)urea
| Molecular Formula | C5H7N5O4 |
|---|---|
| Molecular Weight | 201.05 g/mol |
| LogP | -2.8 |
| Topological Polar Surface Area | 156.0 Ų |
| Hydrogen Bond Donors | 5 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 1 |
| Exact Mass | 201.0498 |
| Heavy Atoms | 14 |
| Complexity | 317.0 |
Chemical Identifiers
| CAS Number | 85066-70-2 |
|---|---|
| SMILES | C1(=O)C(C(=O)NC(=O)N1)(N)NC(=O)N |
| InChIKey | BMYPTJAIXVUJAY-UHFFFAOYSA-N |
Product Overview
N-(5-Amino-2,4,6-trioxohexahydropyrimidin-5-yl)urea (CAS 85066-70-2), with molecular formula C5H7N5O4 and molecular weight 201.05 g/mol. IUPAC: (5-amino-2,4,6-trioxo-1,3-diazinan-5-yl)urea.
Chemical Property Profile of N-(5-Amino-2,4,6-trioxohexahydropyrimidin-5-yl)urea
Property Insights of N-(5-Amino-2,4,6-trioxohexahydropyrimidin-5-yl)urea
The XLogP value of -2.8 indicates that N-(5-Amino-2,4,6-trioxohexahydropyrimidin-5-yl)urea is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 156.0 Ų indicates high polarity, suggesting N-(5-Amino-2,4,6-trioxohexahydropyrimidin-5-yl)urea may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, N-(5-Amino-2,4,6-trioxohexahydropyrimidin-5-yl)urea has 5 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 N-(5-Amino-2,4,6-trioxohexahydropyrimidin-5-yl)urea?
The CAS number of N-(5-Amino-2,4,6-trioxohexahydropyrimidin-5-yl)urea is 85066-70-2.
What is the molecular formula of N-(5-Amino-2,4,6-trioxohexahydropyrimidin-5-yl)urea?
The molecular formula of N-(5-Amino-2,4,6-trioxohexahydropyrimidin-5-yl)urea is C5H7N5O4.
What is the molecular weight of N-(5-Amino-2,4,6-trioxohexahydropyrimidin-5-yl)urea?
The molecular weight of N-(5-Amino-2,4,6-trioxohexahydropyrimidin-5-yl)urea is 201.05 g/mol.
Where can I buy N-(5-Amino-2,4,6-trioxohexahydropyrimidin-5-yl)urea?
You can request a quote for N-(5-Amino-2,4,6-trioxohexahydropyrimidin-5-yl)urea directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-(5-Amino-2,4,6-trioxohexahydropyrimidin-5-yl)urea?
Yes, KEHONG BIO provides custom synthesis services for N-(5-Amino-2,4,6-trioxohexahydropyrimidin-5-yl)urea and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.