![4-[({3-Nitro-2-methylphenyl}imino)methyl]-2-methoxyphenyl acetate structure](/static/products/116/1164552-27-5.png)
4-[({3-Nitro-2-methylphenyl}imino)methyl]-2-methoxyphenyl acetate
TL;DR: 4-[({3-Nitro-2-methylphenyl}imino)methyl]-2-methoxyphenyl acetate (CAS 1164552-27-5) is a chemical compound with molecular formula C17H16N2O5 and molecular weight 328.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[2-methoxy-4-[(2-methyl-3-nitrophenyl)iminomethyl]phenyl] acetate
Also Known As: AN-329/11481519, 4-[({3-nitro-2-methylphenyl}imino)methyl]-2-methoxyphenyl acetate, [2-methoxy-4-[(2-methyl-3-nitrophenyl)iminomethyl]phenyl] acetate, 2-methoxy-4-{[(2-methyl-3-nitrophenyl)imino]methyl}phenyl acetate, 2-methoxy-4-{(E)-[(2-methyl-3-nitrophenyl)imino]methyl}phenyl acetate
| Molecular Formula | C17H16N2O5 |
|---|---|
| Molecular Weight | 328.11 g/mol |
| LogP | 3.1 |
| Topological Polar Surface Area | 93.7 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 5 |
| Exact Mass | 328.10593 |
| Heavy Atoms | 24 |
| Complexity | 476.0 |
Chemical Identifiers
| CAS Number | 1164552-27-5 |
|---|---|
| SMILES | CC1=C(C=CC=C1[N+](=O)[O-])N=CC2=CC(=C(C=C2)OC(=O)C)OC |
| InChIKey | XNGPSYWPKQVWHF-UHFFFAOYSA-N |
Product Overview
4-[({3-Nitro-2-methylphenyl}imino)methyl]-2-methoxyphenyl acetate (CAS 1164552-27-5), with molecular formula C17H16N2O5 and molecular weight 328.11 g/mol. IUPAC: [2-methoxy-4-[(2-methyl-3-nitrophenyl)iminomethyl]phenyl] acetate.
Chemical Property Profile of 4-[({3-Nitro-2-methylphenyl}imino)methyl]-2-methoxyphenyl acetate
Property Insights of 4-[({3-Nitro-2-methylphenyl}imino)methyl]-2-methoxyphenyl acetate
The XLogP value of 3.1 indicates that 4-[({3-Nitro-2-methylphenyl}imino)methyl]-2-methoxyphenyl acetate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 93.7 Ų falls within the moderate polarity range, balancing permeability and solubility for 4-[({3-Nitro-2-methylphenyl}imino)methyl]-2-methoxyphenyl acetate. Following Lipinski's Rule of Five, 4-[({3-Nitro-2-methylphenyl}imino)methyl]-2-methoxyphenyl acetate has 0 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-[({3-Nitro-2-methylphenyl}imino)methyl]-2-methoxyphenyl acetate?
The CAS number of 4-[({3-Nitro-2-methylphenyl}imino)methyl]-2-methoxyphenyl acetate is 1164552-27-5.
What is the molecular formula of 4-[({3-Nitro-2-methylphenyl}imino)methyl]-2-methoxyphenyl acetate?
The molecular formula of 4-[({3-Nitro-2-methylphenyl}imino)methyl]-2-methoxyphenyl acetate is C17H16N2O5.
What is the molecular weight of 4-[({3-Nitro-2-methylphenyl}imino)methyl]-2-methoxyphenyl acetate?
The molecular weight of 4-[({3-Nitro-2-methylphenyl}imino)methyl]-2-methoxyphenyl acetate is 328.11 g/mol.
Where can I buy 4-[({3-Nitro-2-methylphenyl}imino)methyl]-2-methoxyphenyl acetate?
You can request a quote for 4-[({3-Nitro-2-methylphenyl}imino)methyl]-2-methoxyphenyl acetate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-[({3-Nitro-2-methylphenyl}imino)methyl]-2-methoxyphenyl acetate?
Yes, KEHONG BIO provides custom synthesis services for 4-[({3-Nitro-2-methylphenyl}imino)methyl]-2-methoxyphenyl acetate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.