4-Bromo-2'-(diethylamino)-3,5-dihydroxybenzylanilide
TL;DR: 4-Bromo-2'-(diethylamino)-3,5-dihydroxybenzylanilide (CAS 4036-89-9) is a chemical compound with molecular formula C17H19BrN2O3 and molecular weight 378.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-bromo-N-[2-(diethylamino)phenyl]-3,5-dihydroxybenzamide
Also Known As: 4-bromo-2'- -3,5-dihydroxybenzylanilide, 4-Bromo-2'-(diethylamino)-3,5-dihydroxybenzylanilide, 4-bromo-n-[2-(diethylamino)phenyl]-3,5-dihydroxybenzamide, 4-Bromo-3,5-dihydroxy-2 -(diethylamino)benzanilide, 4-bromo-N-(2-(diethylamino)phenyl)-3,5-dihydroxybenzamide
| Molecular Formula | C17H19BrN2O3 |
|---|---|
| Molecular Weight | 378.06 g/mol |
| LogP | 3.6 |
| Topological Polar Surface Area | 72.8 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 378.05792 |
| Heavy Atoms | 23 |
| Complexity | 380.0 |
Chemical Identifiers
| CAS Number | 4036-89-9 |
|---|---|
| SMILES | CCN(CC)C1=CC=CC=C1NC(=O)C2=CC(=C(C(=C2)O)Br)O |
| InChIKey | GWBLGMCMQCZIAU-UHFFFAOYSA-N |
Product Overview
4-Bromo-2'-(diethylamino)-3,5-dihydroxybenzylanilide (CAS 4036-89-9), with molecular formula C17H19BrN2O3 and molecular weight 378.06 g/mol. IUPAC: 4-bromo-N-[2-(diethylamino)phenyl]-3,5-dihydroxybenzamide.
Chemical Property Profile of 4-Bromo-2'-(diethylamino)-3,5-dihydroxybenzylanilide
Property Insights of 4-Bromo-2'-(diethylamino)-3,5-dihydroxybenzylanilide
The XLogP value of 3.6 indicates that 4-Bromo-2'-(diethylamino)-3,5-dihydroxybenzylanilide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 72.8 Ų falls within the moderate polarity range, balancing permeability and solubility for 4-Bromo-2'-(diethylamino)-3,5-dihydroxybenzylanilide. Following Lipinski's Rule of Five, 4-Bromo-2'-(diethylamino)-3,5-dihydroxybenzylanilide has 3 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-Bromo-2'-(diethylamino)-3,5-dihydroxybenzylanilide?
The CAS number of 4-Bromo-2'-(diethylamino)-3,5-dihydroxybenzylanilide is 4036-89-9.
What is the molecular formula of 4-Bromo-2'-(diethylamino)-3,5-dihydroxybenzylanilide?
The molecular formula of 4-Bromo-2'-(diethylamino)-3,5-dihydroxybenzylanilide is C17H19BrN2O3.
What is the molecular weight of 4-Bromo-2'-(diethylamino)-3,5-dihydroxybenzylanilide?
The molecular weight of 4-Bromo-2'-(diethylamino)-3,5-dihydroxybenzylanilide is 378.06 g/mol.
Where can I buy 4-Bromo-2'-(diethylamino)-3,5-dihydroxybenzylanilide?
You can request a quote for 4-Bromo-2'-(diethylamino)-3,5-dihydroxybenzylanilide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-Bromo-2'-(diethylamino)-3,5-dihydroxybenzylanilide?
Yes, KEHONG BIO provides custom synthesis services for 4-Bromo-2'-(diethylamino)-3,5-dihydroxybenzylanilide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.