2-({4-Nitrobenzylidene}amino)-1-{4-nitrophenyl}ethanol
TL;DR: 2-({4-Nitrobenzylidene}amino)-1-{4-nitrophenyl}ethanol (CAS 201349-61-3) is a chemical compound with molecular formula C15H13N3O5 and molecular weight 315.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(4-nitrophenyl)-2-[(4-nitrophenyl)methylideneamino]ethanol
Also Known As: 2-({4-nitrobenzylidene}amino)-1-{4-nitrophenyl}ethanol, 1-(4-nitrophenyl)-2-[(4-nitrophenyl)methylideneamino]ethanol, 4-Nitro-alpha-[[[(4-nitrophenyl)methylene]amino]methyl]benzenemethanol, 1-(4-Nitrophenyl)-2-{[(4-nitrophenyl)methylidene]amino}ethan-1-ol, 4-Nitro-I+/--[[[(4-nitrophenyl)methylene]amino]methyl]benzenemethanol
| Molecular Formula | C15H13N3O5 |
|---|---|
| Molecular Weight | 315.09 g/mol |
| LogP | 2.6555 |
| Topological Polar Surface Area | 118.87 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 6 |
| Exact Mass | 315.0855 |
| Heavy Atoms | 23 |
| Complexity | 725.7825 |
Chemical Identifiers
| CAS Number | 201349-61-3 |
|---|---|
| SMILES | C1=CC(=CC=C1C=NCC(C2=CC=C(C=C2)[N+](=O)[O-])O)[N+](=O)[O-] |
Product Overview
2-({4-Nitrobenzylidene}amino)-1-{4-nitrophenyl}ethanol (CAS 201349-61-3), with molecular formula C15H13N3O5 and molecular weight 315.09 g/mol. IUPAC: 1-(4-nitrophenyl)-2-[(4-nitrophenyl)methylideneamino]ethanol.
Chemical Property Profile of 2-({4-Nitrobenzylidene}amino)-1-{4-nitrophenyl}ethanol
Property Insights of 2-({4-Nitrobenzylidene}amino)-1-{4-nitrophenyl}ethanol
The XLogP value of 2.6555 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-({4-Nitrobenzylidene}amino)-1-{4-nitrophenyl}ethanol. The TPSA of 118.87 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-({4-Nitrobenzylidene}amino)-1-{4-nitrophenyl}ethanol. Following Lipinski's Rule of Five, 2-({4-Nitrobenzylidene}amino)-1-{4-nitrophenyl}ethanol has 1 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 2-({4-Nitrobenzylidene}amino)-1-{4-nitrophenyl}ethanol?
The CAS number of 2-({4-Nitrobenzylidene}amino)-1-{4-nitrophenyl}ethanol is 201349-61-3.
What is the molecular formula of 2-({4-Nitrobenzylidene}amino)-1-{4-nitrophenyl}ethanol?
The molecular formula of 2-({4-Nitrobenzylidene}amino)-1-{4-nitrophenyl}ethanol is C15H13N3O5.
What is the molecular weight of 2-({4-Nitrobenzylidene}amino)-1-{4-nitrophenyl}ethanol?
The molecular weight of 2-({4-Nitrobenzylidene}amino)-1-{4-nitrophenyl}ethanol is 315.09 g/mol.
Where can I buy 2-({4-Nitrobenzylidene}amino)-1-{4-nitrophenyl}ethanol?
You can request a quote for 2-({4-Nitrobenzylidene}amino)-1-{4-nitrophenyl}ethanol directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-({4-Nitrobenzylidene}amino)-1-{4-nitrophenyl}ethanol?
Yes, KEHONG BIO provides custom synthesis services for 2-({4-Nitrobenzylidene}amino)-1-{4-nitrophenyl}ethanol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.