对-(丁氨基)苯甲酸-2-(二乙氨基)乙酯
TL;DR: 对-(丁氨基)苯甲酸-2-(二乙氨基)乙酯 (CAS 3772-42-7) is a chemical compound with molecular formula C17H28N2O2 and molecular weight 292.22 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
对-(丁氨基)苯甲酸-2-(二乙氨基)乙酯
2-(diethylamino)ethyl 4-(butylamino)benzoate
Also Known As: Farmocaine, T-Caine, Dicaine, 2-(Diethylamino)ethyl 4-(butylamino)benzoate, Tetracaine Impurity 10
| Molecular Formula | C17H28N2O2 |
|---|---|
| Molecular Weight | 292.22 g/mol |
| LogP | 4.5 |
| Topological Polar Surface Area | 41.6 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 11 |
| Exact Mass | 292.2151 |
| Heavy Atoms | 21 |
| Complexity | 272.0 |
Chemical Identifiers
| CAS Number | 3772-42-7 |
|---|---|
| SMILES | CCCCNC1=CC=C(C=C1)C(=O)OCCN(CC)CC |
| InChIKey | JQMCLLAJJLVYOC-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 5 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
对-(丁氨基)苯甲酸-2-(二乙氨基)乙酯 (CAS 3772-42-7), with molecular formula C17H28N2O2 and molecular weight 292.22 g/mol. IUPAC: 2-(diethylamino)ethyl 4-(butylamino)benzoate.
Chemical Property Profile of 对-(丁氨基)苯甲酸-2-(二乙氨基)乙酯
Property Insights of 对-(丁氨基)苯甲酸-2-(二乙氨基)乙酯
The XLogP value of 4.5 indicates that 对-(丁氨基)苯甲酸-2-(二乙氨基)乙酯 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 41.6 Ų, 对-(丁氨基)苯甲酸-2-(二乙氨基)乙酯 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 对-(丁氨基)苯甲酸-2-(二乙氨基)乙酯 has 1 hydrogen bond donor(s) and 4 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 对-(丁氨基)苯甲酸-2-(二乙氨基)乙酯?
The CAS number of 对-(丁氨基)苯甲酸-2-(二乙氨基)乙酯 is 3772-42-7.
What is the molecular formula of 对-(丁氨基)苯甲酸-2-(二乙氨基)乙酯?
The molecular formula of 对-(丁氨基)苯甲酸-2-(二乙氨基)乙酯 is C17H28N2O2.
What is the molecular weight of 对-(丁氨基)苯甲酸-2-(二乙氨基)乙酯?
The molecular weight of 对-(丁氨基)苯甲酸-2-(二乙氨基)乙酯 is 292.22 g/mol.
Where can I buy 对-(丁氨基)苯甲酸-2-(二乙氨基)乙酯?
You can request a quote for 对-(丁氨基)苯甲酸-2-(二乙氨基)乙酯 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 对-(丁氨基)苯甲酸-2-(二乙氨基)乙酯?
Yes, KEHONG BIO provides custom synthesis services for 对-(丁氨基)苯甲酸-2-(二乙氨基)乙酯 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.