![5-Nitro-N4-[4-(trifluoromethoxy)phenyl]pyrimidine-4,6-diamine structure](/static/products/4503/450345-08-1.webp)
5-Nitro-N4-[4-(trifluoromethoxy)phenyl]pyrimidine-4,6-diamine
TL;DR: 5-Nitro-N4-[4-(trifluoromethoxy)phenyl]pyrimidine-4,6-diamine (CAS 450345-08-1) is a chemical compound with molecular formula C11H8F3N5O3 and molecular weight 315.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-nitro-4-N-[4-(trifluoromethoxy)phenyl]pyrimidine-4,6-diamine
Also Known As: AB00355994-02, 5-nitro-N-[4-(trifluoromethoxy)phenyl]pyrimidine-4,6-diamine, 5-NITRO-N4-[4-(TRIFLUOROMETHOXY)PHENYL]PYRIMIDINE-4,6-DIAMINE, 5-nitro-4-N-[4-(trifluoromethoxy)phenyl]pyrimidine-4,6-diamine, 5-nitro-N4-(4-(trifluoromethoxy)phenyl)pyrimidine-4,6-diamine
| Molecular Formula | C11H8F3N5O3 |
|---|---|
| Molecular Weight | 315.06 g/mol |
| LogP | 2.6092 |
| Topological Polar Surface Area | 116.2 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 4 |
| Exact Mass | 315.05792 |
| Heavy Atoms | 22 |
| Complexity | 690.36224 |
Chemical Identifiers
| CAS Number | 450345-08-1 |
|---|---|
| SMILES | C1=CC(=CC=C1NC2=NC=NC(=C2[N+](=O)[O-])N)OC(F)(F)F |
Product Overview
5-Nitro-N4-[4-(trifluoromethoxy)phenyl]pyrimidine-4,6-diamine (CAS 450345-08-1), with molecular formula C11H8F3N5O3 and molecular weight 315.06 g/mol. IUPAC: 5-nitro-4-N-[4-(trifluoromethoxy)phenyl]pyrimidine-4,6-diamine.
Chemical Property Profile of 5-Nitro-N4-[4-(trifluoromethoxy)phenyl]pyrimidine-4,6-diamine
Property Insights of 5-Nitro-N4-[4-(trifluoromethoxy)phenyl]pyrimidine-4,6-diamine
The XLogP value of 2.6092 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 5-Nitro-N4-[4-(trifluoromethoxy)phenyl]pyrimidine-4,6-diamine. The TPSA of 116.2 Ų falls within the moderate polarity range, balancing permeability and solubility for 5-Nitro-N4-[4-(trifluoromethoxy)phenyl]pyrimidine-4,6-diamine. Following Lipinski's Rule of Five, 5-Nitro-N4-[4-(trifluoromethoxy)phenyl]pyrimidine-4,6-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 5-Nitro-N4-[4-(trifluoromethoxy)phenyl]pyrimidine-4,6-diamine?
The CAS number of 5-Nitro-N4-[4-(trifluoromethoxy)phenyl]pyrimidine-4,6-diamine is 450345-08-1.
What is the molecular formula of 5-Nitro-N4-[4-(trifluoromethoxy)phenyl]pyrimidine-4,6-diamine?
The molecular formula of 5-Nitro-N4-[4-(trifluoromethoxy)phenyl]pyrimidine-4,6-diamine is C11H8F3N5O3.
What is the molecular weight of 5-Nitro-N4-[4-(trifluoromethoxy)phenyl]pyrimidine-4,6-diamine?
The molecular weight of 5-Nitro-N4-[4-(trifluoromethoxy)phenyl]pyrimidine-4,6-diamine is 315.06 g/mol.
Where can I buy 5-Nitro-N4-[4-(trifluoromethoxy)phenyl]pyrimidine-4,6-diamine?
You can request a quote for 5-Nitro-N4-[4-(trifluoromethoxy)phenyl]pyrimidine-4,6-diamine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 5-Nitro-N4-[4-(trifluoromethoxy)phenyl]pyrimidine-4,6-diamine?
Yes, KEHONG BIO provides custom synthesis services for 5-Nitro-N4-[4-(trifluoromethoxy)phenyl]pyrimidine-4,6-diamine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.