N4-cyclohexyl-N2-(3-methylbutyl)-5-nitropyrimidine-2,4,6-triamine
TL;DR: N4-cyclohexyl-N2-(3-methylbutyl)-5-nitropyrimidine-2,4,6-triamine (CAS 577789-62-9) is a chemical compound with molecular formula C15H26N6O2 and molecular weight 322.21 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-N-cyclohexyl-2-N-(3-methylbutyl)-5-nitropyrimidine-2,4,6-triamine
Also Known As: 4-N-cyclohexyl-2-N-(3-methylbutyl)-5-nitropyrimidine-2,4,6-triamine, N4-cyclohexyl-N2-(3-methylbutyl)-5-nitropyrimidine-2,4,6-triamine, N4-cyclohexyl-N2-isopentyl-5-nitropyrimidine-2,4,6-triamine, [4-amino-6-(cyclohexylamino)-5-nitro-pyrimidin-2-yl]-isoamyl-amine, {6-amino-2-[(3-methylbutyl)amino]-5-nitropyrimidin-4-yl}cyclohexylamine
| Molecular Formula | C15H26N6O2 |
|---|---|
| Molecular Weight | 322.21 g/mol |
| LogP | 3.1696 |
| Topological Polar Surface Area | 119.0 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 7 |
| Exact Mass | 322.21173 |
| Heavy Atoms | 23 |
| Complexity | 543.0138 |
Chemical Identifiers
| CAS Number | 577789-62-9 |
|---|---|
| SMILES | CC(C)CCNC1=NC(=C(C(=N1)NC2CCCCC2)[N+](=O)[O-])N |
Product Overview
N4-cyclohexyl-N2-(3-methylbutyl)-5-nitropyrimidine-2,4,6-triamine (CAS 577789-62-9), with molecular formula C15H26N6O2 and molecular weight 322.21 g/mol. IUPAC: 4-N-cyclohexyl-2-N-(3-methylbutyl)-5-nitropyrimidine-2,4,6-triamine.
Chemical Property Profile of N4-cyclohexyl-N2-(3-methylbutyl)-5-nitropyrimidine-2,4,6-triamine
Property Insights of N4-cyclohexyl-N2-(3-methylbutyl)-5-nitropyrimidine-2,4,6-triamine
The XLogP value of 3.1696 indicates that N4-cyclohexyl-N2-(3-methylbutyl)-5-nitropyrimidine-2,4,6-triamine is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 119.0 Ų falls within the moderate polarity range, balancing permeability and solubility for N4-cyclohexyl-N2-(3-methylbutyl)-5-nitropyrimidine-2,4,6-triamine. Following Lipinski's Rule of Five, N4-cyclohexyl-N2-(3-methylbutyl)-5-nitropyrimidine-2,4,6-triamine has 3 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 N4-cyclohexyl-N2-(3-methylbutyl)-5-nitropyrimidine-2,4,6-triamine?
The CAS number of N4-cyclohexyl-N2-(3-methylbutyl)-5-nitropyrimidine-2,4,6-triamine is 577789-62-9.
What is the molecular formula of N4-cyclohexyl-N2-(3-methylbutyl)-5-nitropyrimidine-2,4,6-triamine?
The molecular formula of N4-cyclohexyl-N2-(3-methylbutyl)-5-nitropyrimidine-2,4,6-triamine is C15H26N6O2.
What is the molecular weight of N4-cyclohexyl-N2-(3-methylbutyl)-5-nitropyrimidine-2,4,6-triamine?
The molecular weight of N4-cyclohexyl-N2-(3-methylbutyl)-5-nitropyrimidine-2,4,6-triamine is 322.21 g/mol.
Where can I buy N4-cyclohexyl-N2-(3-methylbutyl)-5-nitropyrimidine-2,4,6-triamine?
You can request a quote for N4-cyclohexyl-N2-(3-methylbutyl)-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 N4-cyclohexyl-N2-(3-methylbutyl)-5-nitropyrimidine-2,4,6-triamine?
Yes, KEHONG BIO provides custom synthesis services for N4-cyclohexyl-N2-(3-methylbutyl)-5-nitropyrimidine-2,4,6-triamine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.