2-Nitro-4-(piperazin-1-yl)phenol
TL;DR: 2-Nitro-4-(piperazin-1-yl)phenol (CAS 944690-71-5) is a chemical compound with molecular formula C10H13N3O3 and molecular weight 223.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-nitro-4-piperazin-1-ylphenol
Also Known As: 4-piperazinylnitrophenol, 2-nitro-4-(piperazin-1-yl)phenol, 2-nitro-4-piperazin-1-ylphenol, 2-nitro-4-(1-piperazinyl)Phenol, 2-nitro-4-piperazin-1-yl-phenol
| Molecular Formula | C10H13N3O3 |
|---|---|
| Molecular Weight | 223.10 g/mol |
| LogP | 0.71 |
| Topological Polar Surface Area | 78.64 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 2 |
| Exact Mass | 223.09569 |
| Heavy Atoms | 16 |
| Complexity | 402.29578 |
Chemical Identifiers
| CAS Number | 944690-71-5 |
|---|---|
| SMILES | C1CN(CCN1)C2=CC(=C(C=C2)O)[N+](=O)[O-] |
Product Overview
2-Nitro-4-(piperazin-1-yl)phenol (CAS 944690-71-5), with molecular formula C10H13N3O3 and molecular weight 223.10 g/mol. IUPAC: 2-nitro-4-piperazin-1-ylphenol.
Chemical Property Profile of 2-Nitro-4-(piperazin-1-yl)phenol
Property Insights of 2-Nitro-4-(piperazin-1-yl)phenol
The XLogP value of 0.71 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-Nitro-4-(piperazin-1-yl)phenol. The TPSA of 78.64 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-Nitro-4-(piperazin-1-yl)phenol. Following Lipinski's Rule of Five, 2-Nitro-4-(piperazin-1-yl)phenol has 2 hydrogen bond donor(s) and 5 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-Nitro-4-(piperazin-1-yl)phenol?
The CAS number of 2-Nitro-4-(piperazin-1-yl)phenol is 944690-71-5.
What is the molecular formula of 2-Nitro-4-(piperazin-1-yl)phenol?
The molecular formula of 2-Nitro-4-(piperazin-1-yl)phenol is C10H13N3O3.
What is the molecular weight of 2-Nitro-4-(piperazin-1-yl)phenol?
The molecular weight of 2-Nitro-4-(piperazin-1-yl)phenol is 223.10 g/mol.
Where can I buy 2-Nitro-4-(piperazin-1-yl)phenol?
You can request a quote for 2-Nitro-4-(piperazin-1-yl)phenol directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-Nitro-4-(piperazin-1-yl)phenol?
Yes, KEHONG BIO provides custom synthesis services for 2-Nitro-4-(piperazin-1-yl)phenol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.