6-(3,5-dimethylpiperidin-1-yl)-2-N-(3-fluorophenyl)-5-nitropyrimidine-2,4-diamine
TL;DR: 6-(3,5-dimethylpiperidin-1-yl)-2-N-(3-fluorophenyl)-5-nitropyrimidine-2,4-diamine (CAS 713087-99-1) is a chemical compound with molecular formula C17H21FN6O2 and molecular weight 360.17 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-fluorophenyl)-5-nitropyrimidine-2,4-diamine
Also Known As: 6-(3,5-dimethylpiperidin-1-yl)-2-N-(3-fluorophenyl)-5-nitropyrimidine-2,4-diamine, 6-(3,5-DIMETHYLPIPERIDIN-1-YL)-N2-(3-FLUOROPHENYL)-5-NITROPYRIMIDINE-2,4-DIAMINE, (2Z)-6-(3,5-dimethylpiperidin-1-yl)-2-[(3-fluorophenyl)imino]-5-nitro-1,2-dihydropyrimidin-4-amine
| Molecular Formula | C17H21FN6O2 |
|---|---|
| Molecular Weight | 360.17 g/mol |
| LogP | 3.332 |
| Topological Polar Surface Area | 110.21 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 4 |
| Exact Mass | 360.171 |
| Heavy Atoms | 26 |
| Complexity | 820.89557 |
Chemical Identifiers
| CAS Number | 713087-99-1 |
|---|---|
| SMILES | CC1CC(CN(C1)C2=NC(=NC(=C2[N+](=O)[O-])N)NC3=CC(=CC=C3)F)C |
Product Overview
6-(3,5-dimethylpiperidin-1-yl)-2-N-(3-fluorophenyl)-5-nitropyrimidine-2,4-diamine (CAS 713087-99-1), with molecular formula C17H21FN6O2 and molecular weight 360.17 g/mol. IUPAC: 6-(3,5-dimethylpiperidin-1-yl)-2-N-(3-fluorophenyl)-5-nitropyrimidine-2,4-diamine.
Chemical Property Profile of 6-(3,5-dimethylpiperidin-1-yl)-2-N-(3-fluorophenyl)-5-nitropyrimidine-2,4-diamine
Property Insights of 6-(3,5-dimethylpiperidin-1-yl)-2-N-(3-fluorophenyl)-5-nitropyrimidine-2,4-diamine
The XLogP value of 3.332 indicates that 6-(3,5-dimethylpiperidin-1-yl)-2-N-(3-fluorophenyl)-5-nitropyrimidine-2,4-diamine is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 110.21 Ų falls within the moderate polarity range, balancing permeability and solubility for 6-(3,5-dimethylpiperidin-1-yl)-2-N-(3-fluorophenyl)-5-nitropyrimidine-2,4-diamine. Following Lipinski's Rule of Five, 6-(3,5-dimethylpiperidin-1-yl)-2-N-(3-fluorophenyl)-5-nitropyrimidine-2,4-diamine 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 6-(3,5-dimethylpiperidin-1-yl)-2-N-(3-fluorophenyl)-5-nitropyrimidine-2,4-diamine?
The CAS number of 6-(3,5-dimethylpiperidin-1-yl)-2-N-(3-fluorophenyl)-5-nitropyrimidine-2,4-diamine is 713087-99-1.
What is the molecular formula of 6-(3,5-dimethylpiperidin-1-yl)-2-N-(3-fluorophenyl)-5-nitropyrimidine-2,4-diamine?
The molecular formula of 6-(3,5-dimethylpiperidin-1-yl)-2-N-(3-fluorophenyl)-5-nitropyrimidine-2,4-diamine is C17H21FN6O2.
What is the molecular weight of 6-(3,5-dimethylpiperidin-1-yl)-2-N-(3-fluorophenyl)-5-nitropyrimidine-2,4-diamine?
The molecular weight of 6-(3,5-dimethylpiperidin-1-yl)-2-N-(3-fluorophenyl)-5-nitropyrimidine-2,4-diamine is 360.17 g/mol.
Where can I buy 6-(3,5-dimethylpiperidin-1-yl)-2-N-(3-fluorophenyl)-5-nitropyrimidine-2,4-diamine?
You can request a quote for 6-(3,5-dimethylpiperidin-1-yl)-2-N-(3-fluorophenyl)-5-nitropyrimidine-2,4-diamine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 6-(3,5-dimethylpiperidin-1-yl)-2-N-(3-fluorophenyl)-5-nitropyrimidine-2,4-diamine?
Yes, KEHONG BIO provides custom synthesis services for 6-(3,5-dimethylpiperidin-1-yl)-2-N-(3-fluorophenyl)-5-nitropyrimidine-2,4-diamine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.