2-Diethylaminoethyl 4-butylamino-2-ethoxybenzoate
TL;DR: 2-Diethylaminoethyl 4-butylamino-2-ethoxybenzoate (CAS 53352-75-3) is a chemical compound with molecular formula C19H32N2O3 and molecular weight 336.24 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(diethylamino)ethyl 4-(butylamino)-2-ethoxybenzoate
Also Known As: Gynoda, 2-Diethylaminoethyl 4-butylamino-2-ethoxybenzoate, 4- -2-ethoxybenzoicacid2- ethylester, 2-Diethylaminoethyl 4-butylamino-2-O-ethylsalicylat, 2-(diethylamino)ethyl 4-(butylamino)-2-ethoxybenzoate
| Molecular Formula | C19H32N2O3 |
|---|---|
| Molecular Weight | 336.24 g/mol |
| LogP | 4.1 |
| Topological Polar Surface Area | 50.8 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 13 |
| Exact Mass | 336.2413 |
| Heavy Atoms | 24 |
| Complexity | 335.0 |
Chemical Identifiers
| CAS Number | 53352-75-3 |
|---|---|
| SMILES | CCCCNC1=CC(=C(C=C1)C(=O)OCCN(CC)CC)OCC |
| InChIKey | PJAVBVIWGYXOMZ-UHFFFAOYSA-N |
Product Overview
2-Diethylaminoethyl 4-butylamino-2-ethoxybenzoate (CAS 53352-75-3), with molecular formula C19H32N2O3 and molecular weight 336.24 g/mol. IUPAC: 2-(diethylamino)ethyl 4-(butylamino)-2-ethoxybenzoate.
Chemical Property Profile of 2-Diethylaminoethyl 4-butylamino-2-ethoxybenzoate
Property Insights of 2-Diethylaminoethyl 4-butylamino-2-ethoxybenzoate
The XLogP value of 4.1 indicates that 2-Diethylaminoethyl 4-butylamino-2-ethoxybenzoate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 50.8 Ų, 2-Diethylaminoethyl 4-butylamino-2-ethoxybenzoate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-Diethylaminoethyl 4-butylamino-2-ethoxybenzoate 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 2-Diethylaminoethyl 4-butylamino-2-ethoxybenzoate?
The CAS number of 2-Diethylaminoethyl 4-butylamino-2-ethoxybenzoate is 53352-75-3.
What is the molecular formula of 2-Diethylaminoethyl 4-butylamino-2-ethoxybenzoate?
The molecular formula of 2-Diethylaminoethyl 4-butylamino-2-ethoxybenzoate is C19H32N2O3.
What is the molecular weight of 2-Diethylaminoethyl 4-butylamino-2-ethoxybenzoate?
The molecular weight of 2-Diethylaminoethyl 4-butylamino-2-ethoxybenzoate is 336.24 g/mol.
Where can I buy 2-Diethylaminoethyl 4-butylamino-2-ethoxybenzoate?
You can request a quote for 2-Diethylaminoethyl 4-butylamino-2-ethoxybenzoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-Diethylaminoethyl 4-butylamino-2-ethoxybenzoate?
Yes, KEHONG BIO provides custom synthesis services for 2-Diethylaminoethyl 4-butylamino-2-ethoxybenzoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.