4-Bromoacetamidoprocaine
TL;DR: 4-Bromoacetamidoprocaine (CAS 141545-71-3) is a chemical compound with molecular formula C15H21BrN2O3 and molecular weight 356.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(diethylamino)ethyl 4-[(2-bromoacetyl)amino]benzoate
Also Known As: 4-Bromoacetamidoprocaine, 4-Brch2CONH-procaine, 2-(Diethylamino)ethyl 4-((bromoacetyl)amino)benzoate, 2-(diethylamino)ethyl 4-[(2-bromoacetyl)amino]benzoate, 2-diethylaminoethyl 4-[(2-bromoacetyl)amino]benzoate
| Molecular Formula | C15H21BrN2O3 |
|---|---|
| Molecular Weight | 356.07 g/mol |
| LogP | 2.6 |
| Topological Polar Surface Area | 58.6 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 9 |
| Exact Mass | 356.07355 |
| Heavy Atoms | 21 |
| Complexity | 327.0 |
Chemical Identifiers
| CAS Number | 141545-71-3 |
|---|---|
| SMILES | CCN(CC)CCOC(=O)C1=CC=C(C=C1)NC(=O)CBr |
| InChIKey | DPNRCTMDVZUURA-UHFFFAOYSA-N |
Product Overview
4-Bromoacetamidoprocaine (CAS 141545-71-3), with molecular formula C15H21BrN2O3 and molecular weight 356.07 g/mol. IUPAC: 2-(diethylamino)ethyl 4-[(2-bromoacetyl)amino]benzoate.
Chemical Property Profile of 4-Bromoacetamidoprocaine
Property Insights of 4-Bromoacetamidoprocaine
The XLogP value of 2.6 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-Bromoacetamidoprocaine. With a topological polar surface area (TPSA) of 58.6 Ų, 4-Bromoacetamidoprocaine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4-Bromoacetamidoprocaine 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 4-Bromoacetamidoprocaine?
The CAS number of 4-Bromoacetamidoprocaine is 141545-71-3.
What is the molecular formula of 4-Bromoacetamidoprocaine?
The molecular formula of 4-Bromoacetamidoprocaine is C15H21BrN2O3.
What is the molecular weight of 4-Bromoacetamidoprocaine?
The molecular weight of 4-Bromoacetamidoprocaine is 356.07 g/mol.
Where can I buy 4-Bromoacetamidoprocaine?
You can request a quote for 4-Bromoacetamidoprocaine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-Bromoacetamidoprocaine?
Yes, KEHONG BIO provides custom synthesis services for 4-Bromoacetamidoprocaine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.