![Methyl 4,5-dimethoxy-2-{[(2-nitrophenyl)acetyl]amino}benzoate structure](/static/products/6909/690984-57-7.webp)
Methyl 4,5-dimethoxy-2-{[(2-nitrophenyl)acetyl]amino}benzoate
TL;DR: Methyl 4,5-dimethoxy-2-{[(2-nitrophenyl)acetyl]amino}benzoate (CAS 690984-57-7) is a chemical compound with molecular formula C18H18N2O7 and molecular weight 374.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl 4,5-dimethoxy-2-[[2-(2-nitrophenyl)acetyl]amino]benzoate
Also Known As: CBKinase1_002831, CBKinase1_015231, BRD-K19748415-001-01-5, methyl 4,5-dimethoxy-2-{[(2-nitrophenyl)acetyl]amino}benzoate, methyl 4,5-dimethoxy-2-(2-(2-nitrophenyl)acetamido)benzoate
| Molecular Formula | C18H18N2O7 |
|---|---|
| Molecular Weight | 374.11 g/mol |
| LogP | 2.5798 |
| Topological Polar Surface Area | 117.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 7 |
| Exact Mass | 374.1114 |
| Heavy Atoms | 27 |
| Complexity | 880.00903 |
Chemical Identifiers
| CAS Number | 690984-57-7 |
|---|---|
| SMILES | COC1=C(C=C(C(=C1)C(=O)OC)NC(=O)CC2=CC=CC=C2[N+](=O)[O-])OC |
Product Overview
Methyl 4,5-dimethoxy-2-{[(2-nitrophenyl)acetyl]amino}benzoate (CAS 690984-57-7), with molecular formula C18H18N2O7 and molecular weight 374.11 g/mol. IUPAC: methyl 4,5-dimethoxy-2-[[2-(2-nitrophenyl)acetyl]amino]benzoate.
Chemical Property Profile of Methyl 4,5-dimethoxy-2-{[(2-nitrophenyl)acetyl]amino}benzoate
Property Insights of Methyl 4,5-dimethoxy-2-{[(2-nitrophenyl)acetyl]amino}benzoate
The XLogP value of 2.5798 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Methyl 4,5-dimethoxy-2-{[(2-nitrophenyl)acetyl]amino}benzoate. The TPSA of 117.0 Ų falls within the moderate polarity range, balancing permeability and solubility for Methyl 4,5-dimethoxy-2-{[(2-nitrophenyl)acetyl]amino}benzoate. Following Lipinski's Rule of Five, Methyl 4,5-dimethoxy-2-{[(2-nitrophenyl)acetyl]amino}benzoate has 1 hydrogen bond donor(s) and 7 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 Methyl 4,5-dimethoxy-2-{[(2-nitrophenyl)acetyl]amino}benzoate?
The CAS number of Methyl 4,5-dimethoxy-2-{[(2-nitrophenyl)acetyl]amino}benzoate is 690984-57-7.
What is the molecular formula of Methyl 4,5-dimethoxy-2-{[(2-nitrophenyl)acetyl]amino}benzoate?
The molecular formula of Methyl 4,5-dimethoxy-2-{[(2-nitrophenyl)acetyl]amino}benzoate is C18H18N2O7.
What is the molecular weight of Methyl 4,5-dimethoxy-2-{[(2-nitrophenyl)acetyl]amino}benzoate?
The molecular weight of Methyl 4,5-dimethoxy-2-{[(2-nitrophenyl)acetyl]amino}benzoate is 374.11 g/mol.
Where can I buy Methyl 4,5-dimethoxy-2-{[(2-nitrophenyl)acetyl]amino}benzoate?
You can request a quote for Methyl 4,5-dimethoxy-2-{[(2-nitrophenyl)acetyl]amino}benzoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Methyl 4,5-dimethoxy-2-{[(2-nitrophenyl)acetyl]amino}benzoate?
Yes, KEHONG BIO provides custom synthesis services for Methyl 4,5-dimethoxy-2-{[(2-nitrophenyl)acetyl]amino}benzoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.