6-(benzylamino)-3-methyl-5-nitrosopyrimidine-2,4(1H,3H)-dione
TL;DR: 6-(benzylamino)-3-methyl-5-nitrosopyrimidine-2,4(1H,3H)-dione (CAS 5770-20-7) is a chemical compound with molecular formula C12H12N4O3 and molecular weight 260.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
6-(benzylamino)-3-methyl-5-nitroso-1H-pyrimidine-2,4-dione
Also Known As: 6-(benzylamino)-3-methyl-5-nitrosopyrimidine-2,4(1H,3H)-dione, 6-(benzylamino)-3-methyl-5-nitroso-1H-pyrimidine-2,4-dione, 3-methyl-5-nitroso-6-[benzylamino]-1,3-dihydropyrimidine-2,4-dione, 6-(benzylamino)-2-hydroxy-3-methyl-5-nitrosopyrimidin-4(3H)-one
| Molecular Formula | C12H12N4O3 |
|---|---|
| Molecular Weight | 260.09 g/mol |
| LogP | 1.0836 |
| Topological Polar Surface Area | 96.32 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 260.09094 |
| Heavy Atoms | 19 |
| Complexity | 703.14984 |
Chemical Identifiers
| CAS Number | 5770-20-7 |
|---|---|
| SMILES | CN1C(=O)C(=C(NC1=O)NCC2=CC=CC=C2)N=O |
Product Overview
6-(benzylamino)-3-methyl-5-nitrosopyrimidine-2,4(1H,3H)-dione (CAS 5770-20-7), with molecular formula C12H12N4O3 and molecular weight 260.09 g/mol. IUPAC: 6-(benzylamino)-3-methyl-5-nitroso-1H-pyrimidine-2,4-dione.
Chemical Property Profile of 6-(benzylamino)-3-methyl-5-nitrosopyrimidine-2,4(1H,3H)-dione
Property Insights of 6-(benzylamino)-3-methyl-5-nitrosopyrimidine-2,4(1H,3H)-dione
The XLogP value of 1.0836 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 6-(benzylamino)-3-methyl-5-nitrosopyrimidine-2,4(1H,3H)-dione. The TPSA of 96.32 Ų falls within the moderate polarity range, balancing permeability and solubility for 6-(benzylamino)-3-methyl-5-nitrosopyrimidine-2,4(1H,3H)-dione. Following Lipinski's Rule of Five, 6-(benzylamino)-3-methyl-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 6-(benzylamino)-3-methyl-5-nitrosopyrimidine-2,4(1H,3H)-dione?
The CAS number of 6-(benzylamino)-3-methyl-5-nitrosopyrimidine-2,4(1H,3H)-dione is 5770-20-7.
What is the molecular formula of 6-(benzylamino)-3-methyl-5-nitrosopyrimidine-2,4(1H,3H)-dione?
The molecular formula of 6-(benzylamino)-3-methyl-5-nitrosopyrimidine-2,4(1H,3H)-dione is C12H12N4O3.
What is the molecular weight of 6-(benzylamino)-3-methyl-5-nitrosopyrimidine-2,4(1H,3H)-dione?
The molecular weight of 6-(benzylamino)-3-methyl-5-nitrosopyrimidine-2,4(1H,3H)-dione is 260.09 g/mol.
Where can I buy 6-(benzylamino)-3-methyl-5-nitrosopyrimidine-2,4(1H,3H)-dione?
You can request a quote for 6-(benzylamino)-3-methyl-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 6-(benzylamino)-3-methyl-5-nitrosopyrimidine-2,4(1H,3H)-dione?
Yes, KEHONG BIO provides custom synthesis services for 6-(benzylamino)-3-methyl-5-nitrosopyrimidine-2,4(1H,3H)-dione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.