4-Amino-6-(benzylamino)-5-nitropyrimidine
TL;DR: 4-Amino-6-(benzylamino)-5-nitropyrimidine (CAS 23120-18-5) is a chemical compound with molecular formula C11H11N5O2 and molecular weight 245.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-N-benzyl-5-nitropyrimidine-4,6-diamine
Also Known As: 4-amino-6-(benzylamino)-5-nitropyrimidine, 4-N-benzyl-5-nitropyrimidine-4,6-diamine, N-benzyl-5-nitro-pyrimidine-4,6-diamine, (6-amino-5-nitropyrimidin-4-yl)benzylamine, N4-BENZYL-5-NITROPYRIMIDINE-4,6-DIAMINE
| Molecular Formula | C11H11N5O2 |
|---|---|
| Molecular Weight | 245.09 g/mol |
| LogP | 1.5791 |
| Topological Polar Surface Area | 106.97 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 4 |
| Exact Mass | 245.09128 |
| Heavy Atoms | 18 |
| Complexity | 558.615 |
Chemical Identifiers
| CAS Number | 23120-18-5 |
|---|---|
| SMILES | C1=CC=C(C=C1)CNC2=NC=NC(=C2[N+](=O)[O-])N |
Product Overview
4-Amino-6-(benzylamino)-5-nitropyrimidine (CAS 23120-18-5), with molecular formula C11H11N5O2 and molecular weight 245.09 g/mol. IUPAC: 4-N-benzyl-5-nitropyrimidine-4,6-diamine.
Chemical Property Profile of 4-Amino-6-(benzylamino)-5-nitropyrimidine
Property Insights of 4-Amino-6-(benzylamino)-5-nitropyrimidine
The XLogP value of 1.5791 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-Amino-6-(benzylamino)-5-nitropyrimidine. The TPSA of 106.97 Ų falls within the moderate polarity range, balancing permeability and solubility for 4-Amino-6-(benzylamino)-5-nitropyrimidine. Following Lipinski's Rule of Five, 4-Amino-6-(benzylamino)-5-nitropyrimidine has 2 hydrogen bond donor(s) and 6 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-Amino-6-(benzylamino)-5-nitropyrimidine?
The CAS number of 4-Amino-6-(benzylamino)-5-nitropyrimidine is 23120-18-5.
What is the molecular formula of 4-Amino-6-(benzylamino)-5-nitropyrimidine?
The molecular formula of 4-Amino-6-(benzylamino)-5-nitropyrimidine is C11H11N5O2.
What is the molecular weight of 4-Amino-6-(benzylamino)-5-nitropyrimidine?
The molecular weight of 4-Amino-6-(benzylamino)-5-nitropyrimidine is 245.09 g/mol.
Where can I buy 4-Amino-6-(benzylamino)-5-nitropyrimidine?
You can request a quote for 4-Amino-6-(benzylamino)-5-nitropyrimidine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-Amino-6-(benzylamino)-5-nitropyrimidine?
Yes, KEHONG BIO provides custom synthesis services for 4-Amino-6-(benzylamino)-5-nitropyrimidine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.