![5-nitro-N~4~-[3-(trifluoromethyl)phenyl]-2,4-pyrimidinediamine structure](/static/products/3518/351858-26-9.webp)
5-nitro-N~4~-[3-(trifluoromethyl)phenyl]-2,4-pyrimidinediamine
TL;DR: 5-nitro-N~4~-[3-(trifluoromethyl)phenyl]-2,4-pyrimidinediamine (CAS 351858-26-9) is a chemical compound with molecular formula C11H8F3N5O2 and molecular weight 299.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-nitro-4-N-[3-(trifluoromethyl)phenyl]pyrimidine-2,4-diamine
Also Known As: 5-nitro-N~4~-[3-(trifluoromethyl)phenyl]-2,4-pyrimidinediamine, 5-nitro-4-N-[3-(trifluoromethyl)phenyl]pyrimidine-2,4-diamine, 6B-053, 5-nitro-N4-[3-(trifluoromethyl)phenyl]pyrimidine-2,4-diamine
| Molecular Formula | C11H8F3N5O2 |
|---|---|
| Molecular Weight | 299.06 g/mol |
| LogP | 2.7294 |
| Topological Polar Surface Area | 106.97 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 3 |
| Exact Mass | 299.06302 |
| Heavy Atoms | 21 |
| Complexity | 689.7992 |
Chemical Identifiers
| CAS Number | 351858-26-9 |
|---|---|
| SMILES | C1=CC(=CC(=C1)NC2=NC(=NC=C2[N+](=O)[O-])N)C(F)(F)F |
Product Overview
5-nitro-N~4~-[3-(trifluoromethyl)phenyl]-2,4-pyrimidinediamine (CAS 351858-26-9), with molecular formula C11H8F3N5O2 and molecular weight 299.06 g/mol. IUPAC: 5-nitro-4-N-[3-(trifluoromethyl)phenyl]pyrimidine-2,4-diamine.
Chemical Property Profile of 5-nitro-N~4~-[3-(trifluoromethyl)phenyl]-2,4-pyrimidinediamine
Property Insights of 5-nitro-N~4~-[3-(trifluoromethyl)phenyl]-2,4-pyrimidinediamine
The XLogP value of 2.7294 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 5-nitro-N~4~-[3-(trifluoromethyl)phenyl]-2,4-pyrimidinediamine. The TPSA of 106.97 Ų falls within the moderate polarity range, balancing permeability and solubility for 5-nitro-N~4~-[3-(trifluoromethyl)phenyl]-2,4-pyrimidinediamine. Following Lipinski's Rule of Five, 5-nitro-N~4~-[3-(trifluoromethyl)phenyl]-2,4-pyrimidinediamine has 2 hydrogen bond donor(s) and 6 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 5-nitro-N~4~-[3-(trifluoromethyl)phenyl]-2,4-pyrimidinediamine?
The CAS number of 5-nitro-N~4~-[3-(trifluoromethyl)phenyl]-2,4-pyrimidinediamine is 351858-26-9.
What is the molecular formula of 5-nitro-N~4~-[3-(trifluoromethyl)phenyl]-2,4-pyrimidinediamine?
The molecular formula of 5-nitro-N~4~-[3-(trifluoromethyl)phenyl]-2,4-pyrimidinediamine is C11H8F3N5O2.
What is the molecular weight of 5-nitro-N~4~-[3-(trifluoromethyl)phenyl]-2,4-pyrimidinediamine?
The molecular weight of 5-nitro-N~4~-[3-(trifluoromethyl)phenyl]-2,4-pyrimidinediamine is 299.06 g/mol.
Where can I buy 5-nitro-N~4~-[3-(trifluoromethyl)phenyl]-2,4-pyrimidinediamine?
You can request a quote for 5-nitro-N~4~-[3-(trifluoromethyl)phenyl]-2,4-pyrimidinediamine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 5-nitro-N~4~-[3-(trifluoromethyl)phenyl]-2,4-pyrimidinediamine?
Yes, KEHONG BIO provides custom synthesis services for 5-nitro-N~4~-[3-(trifluoromethyl)phenyl]-2,4-pyrimidinediamine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.