TL;DR: Amibegron (CAS 121524-08-1) is a chemical compound with molecular formula C22H26ClNO4 and molecular weight 403.15503 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
ethyl 2-[[(7S)-7-[[(2R)-2-(3-chlorophenyl)-2-hydroxyethyl]amino]-5,6,7,8-tetrahydronaphthalen-2-yl]oxy]acetate
Also Known As: amibegron, amibegronum, Amibegron HCl, Amibegron [USAN], Amibegron [USAN:INN]
| Molecular Formula | C22H26ClNO4 |
| Molecular Weight | 403.15503 g/mol |
| XLogP | 3.9 |
| Topological Polar Surface Area (TPSA) | 67.8 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 9 |
| Exact Mass | 403.15503 Da |
| Heavy Atoms | 28 |
| Complexity | 491.0 |
| SMILES | CCOC(=O)COC1=CC2=C(CC[C@@H](C2)NC[C@@H](C3=CC(=CC=C3)Cl)O)C=C1 |
| InChIKey | RDJQCOBTKKAQAH-FPOVZHCZSA-N |
The XLogP value of 3.9 indicates that Amibegron is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 67.8 Ų falls within the moderate polarity range, balancing permeability and solubility for Amibegron. Following Lipinski's Rule of Five, Amibegron has 2 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of Amibegron is 121524-08-1.
The molecular formula of Amibegron is C22H26ClNO4.
The molecular weight of Amibegron is 403.15503 g/mol.
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