![4-N-[4-(difluoromethylsulfanyl)phenyl]-5-nitropyrimidine-4,6-diamine structure](/static/products/3073/307326-41-6.webp)
4-N-[4-(difluoromethylsulfanyl)phenyl]-5-nitropyrimidine-4,6-diamine
TL;DR: 4-N-[4-(difluoromethylsulfanyl)phenyl]-5-nitropyrimidine-4,6-diamine (CAS 307326-41-6) is a chemical compound with molecular formula C11H9F2N5O2S and molecular weight 313.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-N-[4-(difluoromethylsulfanyl)phenyl]-5-nitropyrimidine-4,6-diamine
Also Known As: F1257-0017, 4-N-[4-(difluoromethylsulfanyl)phenyl]-5-nitropyrimidine-4,6-diamine, N4-{4-[(DIFLUOROMETHYL)SULFANYL]PHENYL}-5-NITROPYRIMIDINE-4,6-DIAMINE, 6-amino-4-[p-(difluoromethylthio)phenylamino]-5-nitropyrimidine, N4-(4-((difluoromethyl)thio)phenyl)-5-nitropyrimidine-4,6-diamine
| Molecular Formula | C11H9F2N5O2S |
|---|---|
| Molecular Weight | 313.04 g/mol |
| LogP | 3.0253 |
| Topological Polar Surface Area | 106.97 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 5 |
| Exact Mass | 313.0445 |
| Heavy Atoms | 21 |
| Complexity | 653.5619 |
Chemical Identifiers
| CAS Number | 307326-41-6 |
|---|---|
| SMILES | C1=CC(=CC=C1NC2=NC=NC(=C2[N+](=O)[O-])N)SC(F)F |
Product Overview
4-N-[4-(difluoromethylsulfanyl)phenyl]-5-nitropyrimidine-4,6-diamine (CAS 307326-41-6), with molecular formula C11H9F2N5O2S and molecular weight 313.04 g/mol. IUPAC: 4-N-[4-(difluoromethylsulfanyl)phenyl]-5-nitropyrimidine-4,6-diamine.
Chemical Property Profile of 4-N-[4-(difluoromethylsulfanyl)phenyl]-5-nitropyrimidine-4,6-diamine
Property Insights of 4-N-[4-(difluoromethylsulfanyl)phenyl]-5-nitropyrimidine-4,6-diamine
The XLogP value of 3.0253 indicates that 4-N-[4-(difluoromethylsulfanyl)phenyl]-5-nitropyrimidine-4,6-diamine is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 106.97 Ų falls within the moderate polarity range, balancing permeability and solubility for 4-N-[4-(difluoromethylsulfanyl)phenyl]-5-nitropyrimidine-4,6-diamine. Following Lipinski's Rule of Five, 4-N-[4-(difluoromethylsulfanyl)phenyl]-5-nitropyrimidine-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 4-N-[4-(difluoromethylsulfanyl)phenyl]-5-nitropyrimidine-4,6-diamine?
The CAS number of 4-N-[4-(difluoromethylsulfanyl)phenyl]-5-nitropyrimidine-4,6-diamine is 307326-41-6.
What is the molecular formula of 4-N-[4-(difluoromethylsulfanyl)phenyl]-5-nitropyrimidine-4,6-diamine?
The molecular formula of 4-N-[4-(difluoromethylsulfanyl)phenyl]-5-nitropyrimidine-4,6-diamine is C11H9F2N5O2S.
What is the molecular weight of 4-N-[4-(difluoromethylsulfanyl)phenyl]-5-nitropyrimidine-4,6-diamine?
The molecular weight of 4-N-[4-(difluoromethylsulfanyl)phenyl]-5-nitropyrimidine-4,6-diamine is 313.04 g/mol.
Where can I buy 4-N-[4-(difluoromethylsulfanyl)phenyl]-5-nitropyrimidine-4,6-diamine?
You can request a quote for 4-N-[4-(difluoromethylsulfanyl)phenyl]-5-nitropyrimidine-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 4-N-[4-(difluoromethylsulfanyl)phenyl]-5-nitropyrimidine-4,6-diamine?
Yes, KEHONG BIO provides custom synthesis services for 4-N-[4-(difluoromethylsulfanyl)phenyl]-5-nitropyrimidine-4,6-diamine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.