N~4~-cyclohexyl-N~2~,N~2~-dimethyl-5-nitropyrimidine-2,4,6-triamine
TL;DR: N~4~-cyclohexyl-N~2~,N~2~-dimethyl-5-nitropyrimidine-2,4,6-triamine (CAS 577700-31-3) is a chemical compound with molecular formula C12H20N6O2 and molecular weight 280.16 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-N-cyclohexyl-2-N,2-N-dimethyl-5-nitropyrimidine-2,4,6-triamine
Also Known As: N4-cyclohexyl-N2,N2-dimethyl-5-nitropyrimidine-2,4,6-triamine, 4-N-cyclohexyl-2-N,2-N-dimethyl-5-nitropyrimidine-2,4,6-triamine, N4-cyclohexyl-N2,N2-dimethyl-5-nitro-pyrimidine-2,4,6-triamine, N~4~-cyclohexyl-N~2~,N~2~-dimethyl-5-nitropyrimidine-2,4,6-triamine
| Molecular Formula | C12H20N6O2 |
|---|---|
| Molecular Weight | 280.16 g/mol |
| LogP | 1.7776 |
| Topological Polar Surface Area | 110.21 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 4 |
| Exact Mass | 280.16476 |
| Heavy Atoms | 20 |
| Complexity | 498.96606 |
Chemical Identifiers
| CAS Number | 577700-31-3 |
|---|---|
| SMILES | CN(C)C1=NC(=C(C(=N1)NC2CCCCC2)[N+](=O)[O-])N |
Product Overview
N~4~-cyclohexyl-N~2~,N~2~-dimethyl-5-nitropyrimidine-2,4,6-triamine (CAS 577700-31-3), with molecular formula C12H20N6O2 and molecular weight 280.16 g/mol. IUPAC: 4-N-cyclohexyl-2-N,2-N-dimethyl-5-nitropyrimidine-2,4,6-triamine.
Chemical Property Profile of N~4~-cyclohexyl-N~2~,N~2~-dimethyl-5-nitropyrimidine-2,4,6-triamine
Property Insights of N~4~-cyclohexyl-N~2~,N~2~-dimethyl-5-nitropyrimidine-2,4,6-triamine
The XLogP value of 1.7776 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N~4~-cyclohexyl-N~2~,N~2~-dimethyl-5-nitropyrimidine-2,4,6-triamine. The TPSA of 110.21 Ų falls within the moderate polarity range, balancing permeability and solubility for N~4~-cyclohexyl-N~2~,N~2~-dimethyl-5-nitropyrimidine-2,4,6-triamine. Following Lipinski's Rule of Five, N~4~-cyclohexyl-N~2~,N~2~-dimethyl-5-nitropyrimidine-2,4,6-triamine has 2 hydrogen bond donor(s) and 7 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~4~-cyclohexyl-N~2~,N~2~-dimethyl-5-nitropyrimidine-2,4,6-triamine?
The CAS number of N~4~-cyclohexyl-N~2~,N~2~-dimethyl-5-nitropyrimidine-2,4,6-triamine is 577700-31-3.
What is the molecular formula of N~4~-cyclohexyl-N~2~,N~2~-dimethyl-5-nitropyrimidine-2,4,6-triamine?
The molecular formula of N~4~-cyclohexyl-N~2~,N~2~-dimethyl-5-nitropyrimidine-2,4,6-triamine is C12H20N6O2.
What is the molecular weight of N~4~-cyclohexyl-N~2~,N~2~-dimethyl-5-nitropyrimidine-2,4,6-triamine?
The molecular weight of N~4~-cyclohexyl-N~2~,N~2~-dimethyl-5-nitropyrimidine-2,4,6-triamine is 280.16 g/mol.
Where can I buy N~4~-cyclohexyl-N~2~,N~2~-dimethyl-5-nitropyrimidine-2,4,6-triamine?
You can request a quote for N~4~-cyclohexyl-N~2~,N~2~-dimethyl-5-nitropyrimidine-2,4,6-triamine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N~4~-cyclohexyl-N~2~,N~2~-dimethyl-5-nitropyrimidine-2,4,6-triamine?
Yes, KEHONG BIO provides custom synthesis services for N~4~-cyclohexyl-N~2~,N~2~-dimethyl-5-nitropyrimidine-2,4,6-triamine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.