N-(2-Carboxy-4,5-dimethoxyphenyl)benzenecarboximidate
TL;DR: N-(2-Carboxy-4,5-dimethoxyphenyl)benzenecarboximidate (CAS 31164-95-1) is a chemical compound with molecular formula C16H14NO5- and molecular weight 300.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-benzamido-4,5-dimethoxybenzoate
Also Known As: 2-benzamido-4,5-dimethoxybenzoate, 2-benzamido-4,5-dimethoxy-benzoate, N-(2-Carboxy-4,5-dimethoxyphenyl)benzenecarboximidate
| Molecular Formula | C16H14NO5- |
|---|---|
| Molecular Weight | 300.09 g/mol |
| LogP | 1.3196 |
| Topological Polar Surface Area | 87.69 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 5 |
| Exact Mass | 300.0872 |
| Heavy Atoms | 22 |
| Complexity | 697.1824 |
Chemical Identifiers
| CAS Number | 31164-95-1 |
|---|---|
| SMILES | COC1=C(C=C(C(=C1)C(=O)[O-])NC(=O)C2=CC=CC=C2)OC |
Product Overview
N-(2-Carboxy-4,5-dimethoxyphenyl)benzenecarboximidate (CAS 31164-95-1), with molecular formula C16H14NO5- and molecular weight 300.09 g/mol. IUPAC: 2-benzamido-4,5-dimethoxybenzoate.
Chemical Property Profile of N-(2-Carboxy-4,5-dimethoxyphenyl)benzenecarboximidate
Property Insights of N-(2-Carboxy-4,5-dimethoxyphenyl)benzenecarboximidate
The XLogP value of 1.3196 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-(2-Carboxy-4,5-dimethoxyphenyl)benzenecarboximidate. The TPSA of 87.69 Ų falls within the moderate polarity range, balancing permeability and solubility for N-(2-Carboxy-4,5-dimethoxyphenyl)benzenecarboximidate. Following Lipinski's Rule of Five, N-(2-Carboxy-4,5-dimethoxyphenyl)benzenecarboximidate has 1 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 N-(2-Carboxy-4,5-dimethoxyphenyl)benzenecarboximidate?
The CAS number of N-(2-Carboxy-4,5-dimethoxyphenyl)benzenecarboximidate is 31164-95-1.
What is the molecular formula of N-(2-Carboxy-4,5-dimethoxyphenyl)benzenecarboximidate?
The molecular formula of N-(2-Carboxy-4,5-dimethoxyphenyl)benzenecarboximidate is C16H14NO5-.
What is the molecular weight of N-(2-Carboxy-4,5-dimethoxyphenyl)benzenecarboximidate?
The molecular weight of N-(2-Carboxy-4,5-dimethoxyphenyl)benzenecarboximidate is 300.09 g/mol.
Where can I buy N-(2-Carboxy-4,5-dimethoxyphenyl)benzenecarboximidate?
You can request a quote for N-(2-Carboxy-4,5-dimethoxyphenyl)benzenecarboximidate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-(2-Carboxy-4,5-dimethoxyphenyl)benzenecarboximidate?
Yes, KEHONG BIO provides custom synthesis services for N-(2-Carboxy-4,5-dimethoxyphenyl)benzenecarboximidate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.