(R)-Celiprolol
TL;DR: (R)-Celiprolol (CAS 91878-52-3) is a chemical compound with molecular formula C20H33N3O4 and molecular weight 379.25 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-[3-acetyl-4-[(2R)-3-(tert-butylamino)-2-hydroxypropoxy]phenyl]-1,1-diethylurea
Also Known As: celiprolol, d-Celiprolol, (R)-Celiprolol, I06-2470, 1,1-Diethyl-3-[3-acetyl-4-[(R)-2-hydroxy-3-[(1,1-dimethylethyl)amino]propoxy]phenyl]urea
| Molecular Formula | C20H33N3O4 |
|---|---|
| Molecular Weight | 379.25 g/mol |
| LogP | 2.8907 |
| Topological Polar Surface Area | 90.9 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 9 |
| Exact Mass | 379.2471 |
| Heavy Atoms | 27 |
| Complexity | 636.60425 |
Chemical Identifiers
| CAS Number | 91878-52-3 |
|---|---|
| SMILES | CCN(CC)C(=O)NC1=CC(=C(C=C1)OC[C@@H](CNC(C)(C)C)O)C(=O)C |
Product Overview
(R)-Celiprolol (CAS 91878-52-3), with molecular formula C20H33N3O4 and molecular weight 379.25 g/mol. IUPAC: 3-[3-acetyl-4-[(2R)-3-(tert-butylamino)-2-hydroxypropoxy]phenyl]-1,1-diethylurea.
Chemical Property Profile of (R)-Celiprolol
Property Insights of (R)-Celiprolol
The XLogP value of 2.8907 suggests moderate lipophilicity, balancing water solubility and membrane permeability for (R)-Celiprolol. The TPSA of 90.9 Ų falls within the moderate polarity range, balancing permeability and solubility for (R)-Celiprolol. Following Lipinski's Rule of Five, (R)-Celiprolol has 3 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 (R)-Celiprolol?
The CAS number of (R)-Celiprolol is 91878-52-3.
What is the molecular formula of (R)-Celiprolol?
The molecular formula of (R)-Celiprolol is C20H33N3O4.
What is the molecular weight of (R)-Celiprolol?
The molecular weight of (R)-Celiprolol is 379.25 g/mol.
Where can I buy (R)-Celiprolol?
You can request a quote for (R)-Celiprolol directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (R)-Celiprolol?
Yes, KEHONG BIO provides custom synthesis services for (R)-Celiprolol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.