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[4-Amino-6-(3,5-dimethylpiperidyl)-5-nitropyrimidin-2-yl](3-methylbutyl)amine
TL;DR: [4-Amino-6-(3,5-dimethylpiperidyl)-5-nitropyrimidin-2-yl](3-methylbutyl)amine (CAS 716339-89-8) is a chemical compound with molecular formula C16H28N6O2 and molecular weight 336.23 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
6-(3,5-dimethylpiperidin-1-yl)-2-N-(3-methylbutyl)-5-nitropyrimidine-2,4-diamine
Also Known As: 6-(3,5-dimethylpiperidin-1-yl)-N2-isopentyl-5-nitropyrimidine-2,4-diamine, [4-amino-6-(3,5-dimethylpiperidyl)-5-nitropyrimidin-2-yl](3-methylbutyl)amine, 6-(3,5-dimethylpiperidin-1-yl)-2-N-(3-methylbutyl)-5-nitropyrimidine-2,4-diamine, 6-(3,5-dimethylpiperidin-1-yl)-N~2~-(3-methylbutyl)-5-nitropyrimidine-2,4-diamine
| Molecular Formula | C16H28N6O2 |
|---|---|
| Molecular Weight | 336.23 g/mol |
| LogP | 2.9073 |
| Topological Polar Surface Area | 110.21 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 6 |
| Exact Mass | 336.2274 |
| Heavy Atoms | 24 |
| Complexity | 582.17554 |
Chemical Identifiers
| CAS Number | 716339-89-8 |
|---|---|
| SMILES | CC1CC(CN(C1)C2=NC(=NC(=C2[N+](=O)[O-])N)NCCC(C)C)C |
Product Overview
[4-Amino-6-(3,5-dimethylpiperidyl)-5-nitropyrimidin-2-yl](3-methylbutyl)amine (CAS 716339-89-8), with molecular formula C16H28N6O2 and molecular weight 336.23 g/mol. IUPAC: 6-(3,5-dimethylpiperidin-1-yl)-2-N-(3-methylbutyl)-5-nitropyrimidine-2,4-diamine.
Chemical Property Profile of [4-Amino-6-(3,5-dimethylpiperidyl)-5-nitropyrimidin-2-yl](3-methylbutyl)amine
Property Insights of [4-Amino-6-(3,5-dimethylpiperidyl)-5-nitropyrimidin-2-yl](3-methylbutyl)amine
The XLogP value of 2.9073 suggests moderate lipophilicity, balancing water solubility and membrane permeability for [4-Amino-6-(3,5-dimethylpiperidyl)-5-nitropyrimidin-2-yl](3-methylbutyl)amine. The TPSA of 110.21 Ų falls within the moderate polarity range, balancing permeability and solubility for [4-Amino-6-(3,5-dimethylpiperidyl)-5-nitropyrimidin-2-yl](3-methylbutyl)amine. Following Lipinski's Rule of Five, [4-Amino-6-(3,5-dimethylpiperidyl)-5-nitropyrimidin-2-yl](3-methylbutyl)amine 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 [4-Amino-6-(3,5-dimethylpiperidyl)-5-nitropyrimidin-2-yl](3-methylbutyl)amine?
The CAS number of [4-Amino-6-(3,5-dimethylpiperidyl)-5-nitropyrimidin-2-yl](3-methylbutyl)amine is 716339-89-8.
What is the molecular formula of [4-Amino-6-(3,5-dimethylpiperidyl)-5-nitropyrimidin-2-yl](3-methylbutyl)amine?
The molecular formula of [4-Amino-6-(3,5-dimethylpiperidyl)-5-nitropyrimidin-2-yl](3-methylbutyl)amine is C16H28N6O2.
What is the molecular weight of [4-Amino-6-(3,5-dimethylpiperidyl)-5-nitropyrimidin-2-yl](3-methylbutyl)amine?
The molecular weight of [4-Amino-6-(3,5-dimethylpiperidyl)-5-nitropyrimidin-2-yl](3-methylbutyl)amine is 336.23 g/mol.
Where can I buy [4-Amino-6-(3,5-dimethylpiperidyl)-5-nitropyrimidin-2-yl](3-methylbutyl)amine?
You can request a quote for [4-Amino-6-(3,5-dimethylpiperidyl)-5-nitropyrimidin-2-yl](3-methylbutyl)amine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for [4-Amino-6-(3,5-dimethylpiperidyl)-5-nitropyrimidin-2-yl](3-methylbutyl)amine?
Yes, KEHONG BIO provides custom synthesis services for [4-Amino-6-(3,5-dimethylpiperidyl)-5-nitropyrimidin-2-yl](3-methylbutyl)amine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.