Benzoic acid, 4-(3,4,5-trimethoxybenzamido)-
TL;DR: Benzoic acid, 4-(3,4,5-trimethoxybenzamido)- (CAS 54057-51-1) is a chemical compound with molecular formula C17H17NO6 and molecular weight 331.1056 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
4-[(3,4,5-trimethoxybenzoyl)amino]benzoic acid
Also Known As: BENZOIC ACID, 4-(3,4,5-TRIMETHOXYBENZAMIDO)-, p-N-(3,4,5-Trimethoxybenzamido)benzoic acid, 4-[(3,4,5-trimethoxybenzoyl)amino]benzoic acid, 4-(3,4,5-TRIMETHOXYBENZAMIDO)BENZOIC ACID, 4-(3,4,5-Trimethoxybenzoylamino)benzoic acid
Application Areas
Top 5 of 1 IPC patent classification(s) from the SureChEMBL global patent database.
Technical Specifications
| Molecular Formula | C17H17NO6 |
| Molecular Weight | 331.1056 g/mol |
| XLogP | 2.2 |
| Topological Polar Surface Area (TPSA) | 94.1 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 6 |
| Exact Mass | 331.1056 Da |
| Heavy Atoms | 24 |
| Complexity | 421.0 |
| SMILES | COC1=CC(=CC(=C1OC)OC)C(=O)NC2=CC=C(C=C2)C(=O)O |
| InChIKey | CSHJCFPMERZZTN-UHFFFAOYSA-N |
Chemical Property Profile of Benzoic acid, 4-(3,4,5-trimethoxybenzamido)-
Property Insights of Benzoic acid, 4-(3,4,5-trimethoxybenzamido)-
The XLogP value of 2.2 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Benzoic acid, 4-(3,4,5-trimethoxybenzamido)-. The TPSA of 94.1 Ų falls within the moderate polarity range, balancing permeability and solubility for Benzoic acid, 4-(3,4,5-trimethoxybenzamido)-. Following Lipinski's Rule of Five, Benzoic acid, 4-(3,4,5-trimethoxybenzamido)- has 2 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of Benzoic acid, 4-(3,4,5-trimethoxybenzamido)-?
The CAS number of Benzoic acid, 4-(3,4,5-trimethoxybenzamido)- is 54057-51-1.
What is the molecular formula of Benzoic acid, 4-(3,4,5-trimethoxybenzamido)-?
The molecular formula of Benzoic acid, 4-(3,4,5-trimethoxybenzamido)- is C17H17NO6.
What is the molecular weight of Benzoic acid, 4-(3,4,5-trimethoxybenzamido)-?
The molecular weight of Benzoic acid, 4-(3,4,5-trimethoxybenzamido)- is 331.1056 g/mol.
Where can I buy Benzoic acid, 4-(3,4,5-trimethoxybenzamido)-?
You can request a quote for Benzoic acid, 4-(3,4,5-trimethoxybenzamido)- directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for Benzoic acid, 4-(3,4,5-trimethoxybenzamido)-?
Yes, CoreyChem provides custom synthesis services for Benzoic acid, 4-(3,4,5-trimethoxybenzamido)- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.