amine structure](/static/products/840/840458-31-3.png)
[6-Amino-5-nitro-2-(phenylamino)pyrimidin-4-yl](2-fluorophenyl)amine
TL;DR: [6-Amino-5-nitro-2-(phenylamino)pyrimidin-4-yl](2-fluorophenyl)amine (CAS 840458-31-3) is a chemical compound with molecular formula C16H13FN6O2 and molecular weight 340.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-N-(2-fluorophenyl)-5-nitro-2-N-phenylpyrimidine-2,4,6-triamine
Also Known As: 4-N-(2-fluorophenyl)-5-nitro-2-N-phenylpyrimidine-2,4,6-triamine, [6-amino-5-nitro-2-(phenylamino)pyrimidin-4-yl](2-fluorophenyl)amine, N~4~-(2-fluorophenyl)-5-nitro-N~2~-phenylpyrimidine-2,4,6-triamine, N4-(2-FLUOROPHENYL)-5-NITRO-N2-PHENYLPYRIMIDINE-2,4,6-TRIAMINE
| Molecular Formula | C16H13FN6O2 |
|---|---|
| Molecular Weight | 340.11 g/mol |
| LogP | 3.5933 |
| Topological Polar Surface Area | 119.0 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 5 |
| Exact Mass | 340.1084 |
| Heavy Atoms | 25 |
| Complexity | 919.7534 |
Chemical Identifiers
| CAS Number | 840458-31-3 |
|---|---|
| SMILES | C1=CC=C(C=C1)NC2=NC(=C(C(=N2)NC3=CC=CC=C3F)[N+](=O)[O-])N |
Product Overview
[6-Amino-5-nitro-2-(phenylamino)pyrimidin-4-yl](2-fluorophenyl)amine (CAS 840458-31-3), with molecular formula C16H13FN6O2 and molecular weight 340.11 g/mol. IUPAC: 4-N-(2-fluorophenyl)-5-nitro-2-N-phenylpyrimidine-2,4,6-triamine.
Chemical Property Profile of [6-Amino-5-nitro-2-(phenylamino)pyrimidin-4-yl](2-fluorophenyl)amine
Property Insights of [6-Amino-5-nitro-2-(phenylamino)pyrimidin-4-yl](2-fluorophenyl)amine
The XLogP value of 3.5933 indicates that [6-Amino-5-nitro-2-(phenylamino)pyrimidin-4-yl](2-fluorophenyl)amine 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 [6-Amino-5-nitro-2-(phenylamino)pyrimidin-4-yl](2-fluorophenyl)amine. Following Lipinski's Rule of Five, [6-Amino-5-nitro-2-(phenylamino)pyrimidin-4-yl](2-fluorophenyl)amine 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 [6-Amino-5-nitro-2-(phenylamino)pyrimidin-4-yl](2-fluorophenyl)amine?
The CAS number of [6-Amino-5-nitro-2-(phenylamino)pyrimidin-4-yl](2-fluorophenyl)amine is 840458-31-3.
What is the molecular formula of [6-Amino-5-nitro-2-(phenylamino)pyrimidin-4-yl](2-fluorophenyl)amine?
The molecular formula of [6-Amino-5-nitro-2-(phenylamino)pyrimidin-4-yl](2-fluorophenyl)amine is C16H13FN6O2.
What is the molecular weight of [6-Amino-5-nitro-2-(phenylamino)pyrimidin-4-yl](2-fluorophenyl)amine?
The molecular weight of [6-Amino-5-nitro-2-(phenylamino)pyrimidin-4-yl](2-fluorophenyl)amine is 340.11 g/mol.
Where can I buy [6-Amino-5-nitro-2-(phenylamino)pyrimidin-4-yl](2-fluorophenyl)amine?
You can request a quote for [6-Amino-5-nitro-2-(phenylamino)pyrimidin-4-yl](2-fluorophenyl)amine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for [6-Amino-5-nitro-2-(phenylamino)pyrimidin-4-yl](2-fluorophenyl)amine?
Yes, KEHONG BIO provides custom synthesis services for [6-Amino-5-nitro-2-(phenylamino)pyrimidin-4-yl](2-fluorophenyl)amine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.