2,4,6-Pyrimidinetriamine, N4-(4-bromo-2-methylphenyl)-5-nitroso-
TL;DR: 2,4,6-Pyrimidinetriamine, N4-(4-bromo-2-methylphenyl)-5-nitroso- (CAS 31694-94-7) is a chemical compound with molecular formula C11H11BrN6O and molecular weight 322.02 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-N-(4-bromo-2-methylphenyl)-5-nitrosopyrimidine-2,4,6-triamine
Also Known As: NCIOpen2_008341, 2,4,6-Pyrimidinetriamine, N4-(4-bromo-2-methylphenyl)-5-nitroso-, N4-(4-Bromo-2-methylphenyl)-5-nitroso-2,4,6-pyrimidinetriamine, n4-(4-bromo-2-methylphenyl)-5-nitrosopyrimidine-2,4,6-triamine, 4-N-(4-bromo-2-methylphenyl)-5-nitrosopyrimidine-2,4,6-triamine
| Molecular Formula | C11H11BrN6O |
|---|---|
| Molecular Weight | 322.02 g/mol |
| LogP | 2.4 |
| Topological Polar Surface Area | 119.0 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 2 |
| Exact Mass | 322.01776 |
| Heavy Atoms | 19 |
| Complexity | 320.0 |
Chemical Identifiers
| CAS Number | 31694-94-7 |
|---|---|
| SMILES | CC1=C(C=CC(=C1)Br)NC2=NC(=NC(=C2N=O)N)N |
| InChIKey | FOQHVFBOCWDLSX-UHFFFAOYSA-N |
Product Overview
2,4,6-Pyrimidinetriamine, N4-(4-bromo-2-methylphenyl)-5-nitroso- (CAS 31694-94-7), with molecular formula C11H11BrN6O and molecular weight 322.02 g/mol. IUPAC: 4-N-(4-bromo-2-methylphenyl)-5-nitrosopyrimidine-2,4,6-triamine.
Chemical Property Profile of 2,4,6-Pyrimidinetriamine, N4-(4-bromo-2-methylphenyl)-5-nitroso-
Property Insights of 2,4,6-Pyrimidinetriamine, N4-(4-bromo-2-methylphenyl)-5-nitroso-
The XLogP value of 2.4 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2,4,6-Pyrimidinetriamine, N4-(4-bromo-2-methylphenyl)-5-nitroso-. The TPSA of 119.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 2,4,6-Pyrimidinetriamine, N4-(4-bromo-2-methylphenyl)-5-nitroso-. Following Lipinski's Rule of Five, 2,4,6-Pyrimidinetriamine, N4-(4-bromo-2-methylphenyl)-5-nitroso- 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 2,4,6-Pyrimidinetriamine, N4-(4-bromo-2-methylphenyl)-5-nitroso-?
The CAS number of 2,4,6-Pyrimidinetriamine, N4-(4-bromo-2-methylphenyl)-5-nitroso- is 31694-94-7.
What is the molecular formula of 2,4,6-Pyrimidinetriamine, N4-(4-bromo-2-methylphenyl)-5-nitroso-?
The molecular formula of 2,4,6-Pyrimidinetriamine, N4-(4-bromo-2-methylphenyl)-5-nitroso- is C11H11BrN6O.
What is the molecular weight of 2,4,6-Pyrimidinetriamine, N4-(4-bromo-2-methylphenyl)-5-nitroso-?
The molecular weight of 2,4,6-Pyrimidinetriamine, N4-(4-bromo-2-methylphenyl)-5-nitroso- is 322.02 g/mol.
Where can I buy 2,4,6-Pyrimidinetriamine, N4-(4-bromo-2-methylphenyl)-5-nitroso-?
You can request a quote for 2,4,6-Pyrimidinetriamine, N4-(4-bromo-2-methylphenyl)-5-nitroso- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2,4,6-Pyrimidinetriamine, N4-(4-bromo-2-methylphenyl)-5-nitroso-?
Yes, KEHONG BIO provides custom synthesis services for 2,4,6-Pyrimidinetriamine, N4-(4-bromo-2-methylphenyl)-5-nitroso- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.