2-(Aziridin-1-yl)-n-(4-fluorophenyl)-6-methyl-5-nitropyrimidin-4-amine
TL;DR: 2-(Aziridin-1-yl)-n-(4-fluorophenyl)-6-methyl-5-nitropyrimidin-4-amine (CAS 1952-97-2) is a chemical compound with molecular formula C13H12FN5O2 and molecular weight 289.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(aziridin-1-yl)-N-(4-fluorophenyl)-6-methyl-5-nitropyrimidin-4-amine
Also Known As: 2-(aziridin-1-yl)-n-(4-fluorophenyl)-6-methyl-5-nitropyrimidin-4-amine, 2-(aziridin-1-yl)-N-(4-fluorophenyl)-6-methyl-5-nitropyrimid
| Molecular Formula | C13H12FN5O2 |
|---|---|
| Molecular Weight | 289.10 g/mol |
| LogP | 3.2 |
| Topological Polar Surface Area | 86.6 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 3 |
| Exact Mass | 289.0975 |
| Heavy Atoms | 21 |
| Complexity | 381.0 |
Chemical Identifiers
| CAS Number | 1952-97-2 |
|---|---|
| SMILES | CC1=C(C(=NC(=N1)N2CC2)NC3=CC=C(C=C3)F)[N+](=O)[O-] |
| InChIKey | DRNOOCOKXXSBSL-UHFFFAOYSA-N |
Product Overview
2-(Aziridin-1-yl)-n-(4-fluorophenyl)-6-methyl-5-nitropyrimidin-4-amine (CAS 1952-97-2), with molecular formula C13H12FN5O2 and molecular weight 289.10 g/mol. IUPAC: 2-(aziridin-1-yl)-N-(4-fluorophenyl)-6-methyl-5-nitropyrimidin-4-amine.
Chemical Property Profile of 2-(Aziridin-1-yl)-n-(4-fluorophenyl)-6-methyl-5-nitropyrimidin-4-amine
Property Insights of 2-(Aziridin-1-yl)-n-(4-fluorophenyl)-6-methyl-5-nitropyrimidin-4-amine
The XLogP value of 3.2 indicates that 2-(Aziridin-1-yl)-n-(4-fluorophenyl)-6-methyl-5-nitropyrimidin-4-amine is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 86.6 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-(Aziridin-1-yl)-n-(4-fluorophenyl)-6-methyl-5-nitropyrimidin-4-amine. Following Lipinski's Rule of Five, 2-(Aziridin-1-yl)-n-(4-fluorophenyl)-6-methyl-5-nitropyrimidin-4-amine has 1 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 2-(Aziridin-1-yl)-n-(4-fluorophenyl)-6-methyl-5-nitropyrimidin-4-amine?
The CAS number of 2-(Aziridin-1-yl)-n-(4-fluorophenyl)-6-methyl-5-nitropyrimidin-4-amine is 1952-97-2.
What is the molecular formula of 2-(Aziridin-1-yl)-n-(4-fluorophenyl)-6-methyl-5-nitropyrimidin-4-amine?
The molecular formula of 2-(Aziridin-1-yl)-n-(4-fluorophenyl)-6-methyl-5-nitropyrimidin-4-amine is C13H12FN5O2.
What is the molecular weight of 2-(Aziridin-1-yl)-n-(4-fluorophenyl)-6-methyl-5-nitropyrimidin-4-amine?
The molecular weight of 2-(Aziridin-1-yl)-n-(4-fluorophenyl)-6-methyl-5-nitropyrimidin-4-amine is 289.10 g/mol.
Where can I buy 2-(Aziridin-1-yl)-n-(4-fluorophenyl)-6-methyl-5-nitropyrimidin-4-amine?
You can request a quote for 2-(Aziridin-1-yl)-n-(4-fluorophenyl)-6-methyl-5-nitropyrimidin-4-amine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-(Aziridin-1-yl)-n-(4-fluorophenyl)-6-methyl-5-nitropyrimidin-4-amine?
Yes, KEHONG BIO provides custom synthesis services for 2-(Aziridin-1-yl)-n-(4-fluorophenyl)-6-methyl-5-nitropyrimidin-4-amine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.