N-(2,4,6-trinitrophenyl)pyrimidin-2-amine
TL;DR: N-(2,4,6-trinitrophenyl)pyrimidin-2-amine (CAS 41230-68-6) is a chemical compound with molecular formula C10H6N6O6 and molecular weight 306.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(2,4,6-trinitrophenyl)pyrimidin-2-amine
Also Known As: N-(2,4,6-trinitrophenyl)pyrimidin-2-amine, 2-Pyrimidinamine, N-(2,4,6-trinitrophenyl)-, pyrimidin-2-yl-(2,4,6-trinitro-phenyl)-amine, 2-[(2,4,6-trinitrophenyl)azamethylene]-3-hydropyrimidine
| Molecular Formula | C10H6N6O6 |
|---|---|
| Molecular Weight | 306.03 g/mol |
| LogP | 1.9448 |
| Topological Polar Surface Area | 167.23 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 9 |
| Rotatable Bonds | 5 |
| Exact Mass | 306.03488 |
| Heavy Atoms | 22 |
| Complexity | 728.7523 |
Chemical Identifiers
| CAS Number | 41230-68-6 |
|---|---|
| SMILES | C1=CN=C(N=C1)NC2=C(C=C(C=C2[N+](=O)[O-])[N+](=O)[O-])[N+](=O)[O-] |
Product Overview
N-(2,4,6-trinitrophenyl)pyrimidin-2-amine (CAS 41230-68-6), with molecular formula C10H6N6O6 and molecular weight 306.03 g/mol. IUPAC: N-(2,4,6-trinitrophenyl)pyrimidin-2-amine.
Chemical Property Profile of N-(2,4,6-trinitrophenyl)pyrimidin-2-amine
Property Insights of N-(2,4,6-trinitrophenyl)pyrimidin-2-amine
The XLogP value of 1.9448 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-(2,4,6-trinitrophenyl)pyrimidin-2-amine. The TPSA of 167.23 Ų indicates high polarity, suggesting N-(2,4,6-trinitrophenyl)pyrimidin-2-amine may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, N-(2,4,6-trinitrophenyl)pyrimidin-2-amine has 1 hydrogen bond donor(s) and 9 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 N-(2,4,6-trinitrophenyl)pyrimidin-2-amine?
The CAS number of N-(2,4,6-trinitrophenyl)pyrimidin-2-amine is 41230-68-6.
What is the molecular formula of N-(2,4,6-trinitrophenyl)pyrimidin-2-amine?
The molecular formula of N-(2,4,6-trinitrophenyl)pyrimidin-2-amine is C10H6N6O6.
What is the molecular weight of N-(2,4,6-trinitrophenyl)pyrimidin-2-amine?
The molecular weight of N-(2,4,6-trinitrophenyl)pyrimidin-2-amine is 306.03 g/mol.
Where can I buy N-(2,4,6-trinitrophenyl)pyrimidin-2-amine?
You can request a quote for N-(2,4,6-trinitrophenyl)pyrimidin-2-amine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-(2,4,6-trinitrophenyl)pyrimidin-2-amine?
Yes, KEHONG BIO provides custom synthesis services for N-(2,4,6-trinitrophenyl)pyrimidin-2-amine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.