4-N-(4-bromophenyl)-4-N-butyl-5-nitrosopyrimidine-2,4,6-triamine
TL;DR: 4-N-(4-bromophenyl)-4-N-butyl-5-nitrosopyrimidine-2,4,6-triamine (CAS 317-20-4) is a chemical compound with molecular formula C14H17BrN6O and molecular weight 364.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-N-(4-bromophenyl)-4-N-butyl-5-nitrosopyrimidine-2,4,6-triamine
Also Known As: n4-(4-bromophenyl)-n4-butyl-5-nitrosopyrimidine-2,4,6-triamine, 4-N-(4-bromophenyl)-4-N-butyl-5-nitrosopyrimidine-2,4,6-triamine, N4-(4-bromo-phenyl)-N4-butyl-5-nitroso-pyrimidine-2,4,6-tria, N~4~-(4-Bromophenyl)-N~4~-butyl-2-imino-5-nitroso-1,2-dihydropyrimidine-4,6-diamine
| Molecular Formula | C14H17BrN6O |
|---|---|
| Molecular Weight | 364.06 g/mol |
| LogP | 3.4 |
| Topological Polar Surface Area | 110.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 5 |
| Exact Mass | 364.06473 |
| Heavy Atoms | 22 |
| Complexity | 352.0 |
Chemical Identifiers
| CAS Number | 317-20-4 |
|---|---|
| SMILES | CCCCN(C1=CC=C(C=C1)Br)C2=NC(=NC(=C2N=O)N)N |
| InChIKey | NHLYAVPXLCJHTE-UHFFFAOYSA-N |
Product Overview
4-N-(4-bromophenyl)-4-N-butyl-5-nitrosopyrimidine-2,4,6-triamine (CAS 317-20-4), with molecular formula C14H17BrN6O and molecular weight 364.06 g/mol. IUPAC: 4-N-(4-bromophenyl)-4-N-butyl-5-nitrosopyrimidine-2,4,6-triamine.
Chemical Property Profile of 4-N-(4-bromophenyl)-4-N-butyl-5-nitrosopyrimidine-2,4,6-triamine
Property Insights of 4-N-(4-bromophenyl)-4-N-butyl-5-nitrosopyrimidine-2,4,6-triamine
The XLogP value of 3.4 indicates that 4-N-(4-bromophenyl)-4-N-butyl-5-nitrosopyrimidine-2,4,6-triamine is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 110.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 4-N-(4-bromophenyl)-4-N-butyl-5-nitrosopyrimidine-2,4,6-triamine. Following Lipinski's Rule of Five, 4-N-(4-bromophenyl)-4-N-butyl-5-nitrosopyrimidine-2,4,6-triamine 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-bromophenyl)-4-N-butyl-5-nitrosopyrimidine-2,4,6-triamine?
The CAS number of 4-N-(4-bromophenyl)-4-N-butyl-5-nitrosopyrimidine-2,4,6-triamine is 317-20-4.
What is the molecular formula of 4-N-(4-bromophenyl)-4-N-butyl-5-nitrosopyrimidine-2,4,6-triamine?
The molecular formula of 4-N-(4-bromophenyl)-4-N-butyl-5-nitrosopyrimidine-2,4,6-triamine is C14H17BrN6O.
What is the molecular weight of 4-N-(4-bromophenyl)-4-N-butyl-5-nitrosopyrimidine-2,4,6-triamine?
The molecular weight of 4-N-(4-bromophenyl)-4-N-butyl-5-nitrosopyrimidine-2,4,6-triamine is 364.06 g/mol.
Where can I buy 4-N-(4-bromophenyl)-4-N-butyl-5-nitrosopyrimidine-2,4,6-triamine?
You can request a quote for 4-N-(4-bromophenyl)-4-N-butyl-5-nitrosopyrimidine-2,4,6-triamine 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-bromophenyl)-4-N-butyl-5-nitrosopyrimidine-2,4,6-triamine?
Yes, KEHONG BIO provides custom synthesis services for 4-N-(4-bromophenyl)-4-N-butyl-5-nitrosopyrimidine-2,4,6-triamine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.