TL;DR: Nebivolol (CAS 99200-09-6) is a chemical compound with molecular formula C22H25F2NO4 and molecular weight 405.17517 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
1-(6-fluoro-3,4-dihydro-2H-chromen-2-yl)-2-[[2-(6-fluoro-3,4-dihydro-2H-chromen-2-yl)-2-hydroxyethyl]amino]ethanol
Also Known As: Nebivolol, Bystolic, Nebilet, Levonebivolol, Nebivololum
Top 5 of 10 IPC patent classification(s) from the SureChEMBL global patent database.
| Molecular Formula | C22H25F2NO4 |
| Molecular Weight | 405.17517 g/mol |
| XLogP | 3.0 |
| Topological Polar Surface Area (TPSA) | 71.0 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 6 |
| Exact Mass | 405.17517 Da |
| Heavy Atoms | 29 |
| Complexity | 483.0 |
| Melting Point | 223.0-228.0 |
| Solubility | 0.091g/100mL |
| SMILES | C1CC2=C(C=CC(=C2)F)OC1C(CNCC(C3CCC4=C(O3)C=CC(=C4)F)O)O |
| InChIKey | KOHIRBRYDXPAMZ-UHFFFAOYSA-N |
The XLogP value of 3.0 indicates that Nebivolol is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 71.0 Ų falls within the moderate polarity range, balancing permeability and solubility for Nebivolol. Following Lipinski's Rule of Five, Nebivolol has 3 hydrogen bond donor(s) and 7 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of Nebivolol is 99200-09-6.
The molecular formula of Nebivolol is C22H25F2NO4.
The molecular weight of Nebivolol is 405.17517 g/mol.
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