(S)-Metoprolol
TL;DR: (S)-Metoprolol (CAS 81024-42-2) is a chemical compound with molecular formula C15H25NO3 and molecular weight 267.18 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(2S)-1-[4-(2-methoxyethyl)phenoxy]-3-(propan-2-ylamino)propan-2-ol
Also Known As: (S)-Metoprolol, (-)-Metoprolol, s-metoprolol, l-Metoprolol, (S)-(-)-Metoprolol
| Molecular Formula | C15H25NO3 |
|---|---|
| Molecular Weight | 267.18 g/mol |
| LogP | 1.9 |
| Topological Polar Surface Area | 50.7 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 9 |
| Exact Mass | 267.18344 |
| Heavy Atoms | 19 |
| Complexity | 215.0 |
Chemical Identifiers
| CAS Number | 81024-42-2 |
|---|---|
| SMILES | CC(C)NC[C@@H](COC1=CC=C(C=C1)CCOC)O |
| InChIKey | IUBSYMUCCVWXPE-AWEZNQCLSA-N |
Patent-Derived Application Labels
Derived from 15 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
(S)-Metoprolol (CAS 81024-42-2), with molecular formula C15H25NO3 and molecular weight 267.18 g/mol. IUPAC: (2S)-1-[4-(2-methoxyethyl)phenoxy]-3-(propan-2-ylamino)propan-2-ol.
Chemical Property Profile of (S)-Metoprolol
Property Insights of (S)-Metoprolol
The XLogP value of 1.9 suggests moderate lipophilicity, balancing water solubility and membrane permeability for (S)-Metoprolol. With a topological polar surface area (TPSA) of 50.7 Ų, (S)-Metoprolol exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, (S)-Metoprolol has 2 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 (S)-Metoprolol?
The CAS number of (S)-Metoprolol is 81024-42-2.
What is the molecular formula of (S)-Metoprolol?
The molecular formula of (S)-Metoprolol is C15H25NO3.
What is the molecular weight of (S)-Metoprolol?
The molecular weight of (S)-Metoprolol is 267.18 g/mol.
Where can I buy (S)-Metoprolol?
You can request a quote for (S)-Metoprolol directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (S)-Metoprolol?
Yes, KEHONG BIO provides custom synthesis services for (S)-Metoprolol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.