3-methyl-6-(methylamino)-5-nitrosopyrimidine-2,4(1H,3H)-dione
TL;DR: 3-methyl-6-(methylamino)-5-nitrosopyrimidine-2,4(1H,3H)-dione (CAS 5817-75-4) is a chemical compound with molecular formula C6H8N4O3 and molecular weight 184.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-methyl-6-(methylamino)-5-nitroso-1H-pyrimidine-2,4-dione
Also Known As: 5-Nitroso-6-methylamino-3-methyl-uracil, 3-methyl-6-(methylamino)-5-nitrosopyrimidine-2,4(1H,3H)-dione, 2,4(1h,3h)-pyrimidinedione, 3-methyl-6-(methylamino)-5-nitroso-, 3-methyl-6-(methylamino)-5-nitroso-1H-pyrimidine-2,4-dione, 3-Methyl-6-methylamino-5-nitroso-1h-pyrimidine-2,4-dione
| Molecular Formula | C6H8N4O3 |
|---|---|
| Molecular Weight | 184.06 g/mol |
| LogP | -0.5 |
| Topological Polar Surface Area | 90.9 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 1 |
| Exact Mass | 184.05965 |
| Heavy Atoms | 13 |
| Complexity | 309.0 |
Chemical Identifiers
| CAS Number | 5817-75-4 |
|---|---|
| SMILES | CNC1=C(C(=O)N(C(=O)N1)C)N=O |
| InChIKey | BDGPUPPAEXFPRL-UHFFFAOYSA-N |
Product Overview
3-methyl-6-(methylamino)-5-nitrosopyrimidine-2,4(1H,3H)-dione (CAS 5817-75-4), with molecular formula C6H8N4O3 and molecular weight 184.06 g/mol. IUPAC: 3-methyl-6-(methylamino)-5-nitroso-1H-pyrimidine-2,4-dione.
Chemical Property Profile of 3-methyl-6-(methylamino)-5-nitrosopyrimidine-2,4(1H,3H)-dione
Property Insights of 3-methyl-6-(methylamino)-5-nitrosopyrimidine-2,4(1H,3H)-dione
The XLogP value of -0.5 indicates that 3-methyl-6-(methylamino)-5-nitrosopyrimidine-2,4(1H,3H)-dione is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 90.9 Ų falls within the moderate polarity range, balancing permeability and solubility for 3-methyl-6-(methylamino)-5-nitrosopyrimidine-2,4(1H,3H)-dione. Following Lipinski's Rule of Five, 3-methyl-6-(methylamino)-5-nitrosopyrimidine-2,4(1H,3H)-dione 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 3-methyl-6-(methylamino)-5-nitrosopyrimidine-2,4(1H,3H)-dione?
The CAS number of 3-methyl-6-(methylamino)-5-nitrosopyrimidine-2,4(1H,3H)-dione is 5817-75-4.
What is the molecular formula of 3-methyl-6-(methylamino)-5-nitrosopyrimidine-2,4(1H,3H)-dione?
The molecular formula of 3-methyl-6-(methylamino)-5-nitrosopyrimidine-2,4(1H,3H)-dione is C6H8N4O3.
What is the molecular weight of 3-methyl-6-(methylamino)-5-nitrosopyrimidine-2,4(1H,3H)-dione?
The molecular weight of 3-methyl-6-(methylamino)-5-nitrosopyrimidine-2,4(1H,3H)-dione is 184.06 g/mol.
Where can I buy 3-methyl-6-(methylamino)-5-nitrosopyrimidine-2,4(1H,3H)-dione?
You can request a quote for 3-methyl-6-(methylamino)-5-nitrosopyrimidine-2,4(1H,3H)-dione directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-methyl-6-(methylamino)-5-nitrosopyrimidine-2,4(1H,3H)-dione?
Yes, KEHONG BIO provides custom synthesis services for 3-methyl-6-(methylamino)-5-nitrosopyrimidine-2,4(1H,3H)-dione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.