Propranolol phenobarbital
TL;DR: Propranolol phenobarbital (CAS 37419-67-3) is a chemical compound with molecular formula C28H33N3O5 and molecular weight 491.24 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-ethyl-5-phenyl-1,3-diazinane-2,4,6-trione;1-naphthalen-1-yloxy-3-(propan-2-ylamino)propan-2-ol
Also Known As: Propranolol phenobarbital, BETARYL, EINECS 248-204-0, EINECS 253-501-3, PROPRANOLOL PHENOBARBITAL [WHO-DD]
| Molecular Formula | C28H33N3O5 |
|---|---|
| Molecular Weight | 491.24 g/mol |
| LogP | 3.2779 |
| Topological Polar Surface Area | 116.76 Ų |
| Hydrogen Bond Donors | 4 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 8 |
| Exact Mass | 491.24203 |
| Heavy Atoms | 36 |
| Complexity | 1170.7742 |
Chemical Identifiers
| CAS Number | 37419-67-3 |
|---|---|
| SMILES | CCC1(C(=O)NC(=O)NC1=O)C2=CC=CC=C2.CC(C)NCC(COC1=CC=CC2=CC=CC=C21)O |
Product Overview
Propranolol phenobarbital (CAS 37419-67-3), with molecular formula C28H33N3O5 and molecular weight 491.24 g/mol. IUPAC: 5-ethyl-5-phenyl-1,3-diazinane-2,4,6-trione;1-naphthalen-1-yloxy-3-(propan-2-ylamino)propan-2-ol.
Chemical Property Profile of Propranolol phenobarbital
Property Insights of Propranolol phenobarbital
The XLogP value of 3.2779 indicates that Propranolol phenobarbital is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 116.76 Ų falls within the moderate polarity range, balancing permeability and solubility for Propranolol phenobarbital. Following Lipinski's Rule of Five, Propranolol phenobarbital has 4 hydrogen bond donor(s) and 6 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 Propranolol phenobarbital?
The CAS number of Propranolol phenobarbital is 37419-67-3.
What is the molecular formula of Propranolol phenobarbital?
The molecular formula of Propranolol phenobarbital is C28H33N3O5.
What is the molecular weight of Propranolol phenobarbital?
The molecular weight of Propranolol phenobarbital is 491.24 g/mol.
Where can I buy Propranolol phenobarbital?
You can request a quote for Propranolol phenobarbital directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Propranolol phenobarbital?
Yes, KEHONG BIO provides custom synthesis services for Propranolol phenobarbital and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.