2-(4-benzylpiperazin-1-yl)-6-(2,6-dimethylmorpholin-4-yl)-5-nitropyrimidin-4-amine
TL;DR: 2-(4-benzylpiperazin-1-yl)-6-(2,6-dimethylmorpholin-4-yl)-5-nitropyrimidin-4-amine (CAS 714225-32-8) is a chemical compound with molecular formula C21H29N7O3 and molecular weight 427.23 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(4-benzylpiperazin-1-yl)-6-(2,6-dimethylmorpholin-4-yl)-5-nitropyrimidin-4-amine
Also Known As: 2-(4-benzylpiperazin-1-yl)-6-(2,6-dimethylmorpholin-4-yl)-5-nitropyrimidin-4-amine, 2-(4-benzylpiperazin-1-yl)-6-(2,6-dimethylmorpholin-4-yl)-5-nitro-pyrimidin-4-amine, 2-(4-benzylpiperazin-1-yl)-6-(2,6-dimethylmorpholino)-5-nitropyrimidin-4-amine, 6-(2,6-dimethylmorpholin-4-yl)-5-nitro-2-[4-benzylpiperazinyl]pyrimidine-4-yla mine
| Molecular Formula | C21H29N7O3 |
|---|---|
| Molecular Weight | 427.23 g/mol |
| LogP | 1.9028 |
| Topological Polar Surface Area | 113.89 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 9 |
| Rotatable Bonds | 5 |
| Exact Mass | 427.2332 |
| Heavy Atoms | 31 |
| Complexity | 908.6894 |
Chemical Identifiers
| CAS Number | 714225-32-8 |
|---|---|
| SMILES | CC1CN(CC(O1)C)C2=NC(=NC(=C2[N+](=O)[O-])N)N3CCN(CC3)CC4=CC=CC=C4 |
Product Overview
2-(4-benzylpiperazin-1-yl)-6-(2,6-dimethylmorpholin-4-yl)-5-nitropyrimidin-4-amine (CAS 714225-32-8), with molecular formula C21H29N7O3 and molecular weight 427.23 g/mol. IUPAC: 2-(4-benzylpiperazin-1-yl)-6-(2,6-dimethylmorpholin-4-yl)-5-nitropyrimidin-4-amine.
Chemical Property Profile of 2-(4-benzylpiperazin-1-yl)-6-(2,6-dimethylmorpholin-4-yl)-5-nitropyrimidin-4-amine
Property Insights of 2-(4-benzylpiperazin-1-yl)-6-(2,6-dimethylmorpholin-4-yl)-5-nitropyrimidin-4-amine
The XLogP value of 1.9028 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-(4-benzylpiperazin-1-yl)-6-(2,6-dimethylmorpholin-4-yl)-5-nitropyrimidin-4-amine. The TPSA of 113.89 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-(4-benzylpiperazin-1-yl)-6-(2,6-dimethylmorpholin-4-yl)-5-nitropyrimidin-4-amine. Following Lipinski's Rule of Five, 2-(4-benzylpiperazin-1-yl)-6-(2,6-dimethylmorpholin-4-yl)-5-nitropyrimidin-4-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 2-(4-benzylpiperazin-1-yl)-6-(2,6-dimethylmorpholin-4-yl)-5-nitropyrimidin-4-amine?
The CAS number of 2-(4-benzylpiperazin-1-yl)-6-(2,6-dimethylmorpholin-4-yl)-5-nitropyrimidin-4-amine is 714225-32-8.
What is the molecular formula of 2-(4-benzylpiperazin-1-yl)-6-(2,6-dimethylmorpholin-4-yl)-5-nitropyrimidin-4-amine?
The molecular formula of 2-(4-benzylpiperazin-1-yl)-6-(2,6-dimethylmorpholin-4-yl)-5-nitropyrimidin-4-amine is C21H29N7O3.
What is the molecular weight of 2-(4-benzylpiperazin-1-yl)-6-(2,6-dimethylmorpholin-4-yl)-5-nitropyrimidin-4-amine?
The molecular weight of 2-(4-benzylpiperazin-1-yl)-6-(2,6-dimethylmorpholin-4-yl)-5-nitropyrimidin-4-amine is 427.23 g/mol.
Where can I buy 2-(4-benzylpiperazin-1-yl)-6-(2,6-dimethylmorpholin-4-yl)-5-nitropyrimidin-4-amine?
You can request a quote for 2-(4-benzylpiperazin-1-yl)-6-(2,6-dimethylmorpholin-4-yl)-5-nitropyrimidin-4-amine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-(4-benzylpiperazin-1-yl)-6-(2,6-dimethylmorpholin-4-yl)-5-nitropyrimidin-4-amine?
Yes, KEHONG BIO provides custom synthesis services for 2-(4-benzylpiperazin-1-yl)-6-(2,6-dimethylmorpholin-4-yl)-5-nitropyrimidin-4-amine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.