![Methyl 2-[(4-tert-butylbenzoyl)amino]benzoate structure](/static/products/755/75541-82-1.png)
Methyl 2-[(4-tert-butylbenzoyl)amino]benzoate
TL;DR: Methyl 2-[(4-tert-butylbenzoyl)amino]benzoate (CAS 75541-82-1) is a chemical compound with molecular formula C19H21NO3 and molecular weight 311.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl 2-[(4-tert-butylbenzoyl)amino]benzoate
Also Known As: methyl 2-[(4-tert-butylbenzoyl)amino]benzoate, Methyl 2-(4-tert-butylbenzoylamino)benzoate, methyl 2-(4-tert-butylbenzoyl-amino)benzoate, methyl 2-[(4-tert-butylbenzene)amido]benzoate, METHYL 2-(4-TERT-BUTYLBENZAMIDO)BENZOATE
| Molecular Formula | C19H21NO3 |
|---|---|
| Molecular Weight | 311.15 g/mol |
| LogP | 5.0 |
| Topological Polar Surface Area | 55.4 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 5 |
| Exact Mass | 311.15213 |
| Heavy Atoms | 23 |
| Complexity | 419.0 |
Chemical Identifiers
| CAS Number | 75541-82-1 |
|---|---|
| SMILES | CC(C)(C)C1=CC=C(C=C1)C(=O)NC2=CC=CC=C2C(=O)OC |
| InChIKey | YSSGSPKQILZUHE-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 3 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Methyl 2-[(4-tert-butylbenzoyl)amino]benzoate (CAS 75541-82-1), with molecular formula C19H21NO3 and molecular weight 311.15 g/mol. IUPAC: methyl 2-[(4-tert-butylbenzoyl)amino]benzoate.
Chemical Property Profile of Methyl 2-[(4-tert-butylbenzoyl)amino]benzoate
Property Insights of Methyl 2-[(4-tert-butylbenzoyl)amino]benzoate
The XLogP value of 5.0 indicates that Methyl 2-[(4-tert-butylbenzoyl)amino]benzoate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 55.4 Ų, Methyl 2-[(4-tert-butylbenzoyl)amino]benzoate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Methyl 2-[(4-tert-butylbenzoyl)amino]benzoate has 1 hydrogen bond donor(s) and 3 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 2-[(4-tert-butylbenzoyl)amino]benzoate?
The CAS number of Methyl 2-[(4-tert-butylbenzoyl)amino]benzoate is 75541-82-1.
What is the molecular formula of Methyl 2-[(4-tert-butylbenzoyl)amino]benzoate?
The molecular formula of Methyl 2-[(4-tert-butylbenzoyl)amino]benzoate is C19H21NO3.
What is the molecular weight of Methyl 2-[(4-tert-butylbenzoyl)amino]benzoate?
The molecular weight of Methyl 2-[(4-tert-butylbenzoyl)amino]benzoate is 311.15 g/mol.
Where can I buy Methyl 2-[(4-tert-butylbenzoyl)amino]benzoate?
You can request a quote for Methyl 2-[(4-tert-butylbenzoyl)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 2-[(4-tert-butylbenzoyl)amino]benzoate?
Yes, KEHONG BIO provides custom synthesis services for Methyl 2-[(4-tert-butylbenzoyl)amino]benzoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.