4'-Benzyloxy Carvedilol
TL;DR: 4'-Benzyloxy Carvedilol (CAS 1217733-91-9) is a chemical compound with molecular formula C31H32N2O5 and molecular weight 512.23 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(9H-carbazol-4-yloxy)-3-[2-(2-methoxy-4-phenylmethoxyphenoxy)ethylamino]propan-2-ol
Also Known As: 4'-Benzyloxy Carvedilol, 4/'-Benzyloxy Carvedilol, Carvedilol p-Benzyloxy Impurity, 4'-Benzyloxy Carvedilol, 4'-BENZYLOXY-CARVEDILOL
| Molecular Formula | C31H32N2O5 |
|---|---|
| Molecular Weight | 512.23 g/mol |
| LogP | 5.317 |
| Topological Polar Surface Area | 84.97 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 13 |
| Exact Mass | 512.23114 |
| Heavy Atoms | 38 |
| Complexity | 1467.7042 |
Chemical Identifiers
| CAS Number | 1217733-91-9 |
|---|---|
| SMILES | COC1=C(C=CC(=C1)OCC2=CC=CC=C2)OCCNCC(COC3=CC=CC4=C3C5=CC=CC=C5N4)O |
Product Overview
4'-Benzyloxy Carvedilol (CAS 1217733-91-9), with molecular formula C31H32N2O5 and molecular weight 512.23 g/mol. IUPAC: 1-(9H-carbazol-4-yloxy)-3-[2-(2-methoxy-4-phenylmethoxyphenoxy)ethylamino]propan-2-ol.
Chemical Property Profile of 4'-Benzyloxy Carvedilol
Property Insights of 4'-Benzyloxy Carvedilol
The XLogP value of 5.317 indicates that 4'-Benzyloxy Carvedilol is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 84.97 Ų falls within the moderate polarity range, balancing permeability and solubility for 4'-Benzyloxy Carvedilol. Following Lipinski's Rule of Five, 4'-Benzyloxy Carvedilol has 3 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 4'-Benzyloxy Carvedilol?
The CAS number of 4'-Benzyloxy Carvedilol is 1217733-91-9.
What is the molecular formula of 4'-Benzyloxy Carvedilol?
The molecular formula of 4'-Benzyloxy Carvedilol is C31H32N2O5.
What is the molecular weight of 4'-Benzyloxy Carvedilol?
The molecular weight of 4'-Benzyloxy Carvedilol is 512.23 g/mol.
Where can I buy 4'-Benzyloxy Carvedilol?
You can request a quote for 4'-Benzyloxy Carvedilol directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4'-Benzyloxy Carvedilol?
Yes, KEHONG BIO provides custom synthesis services for 4'-Benzyloxy Carvedilol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.