TL;DR: Lopinavir (CAS 192725-17-0) is a chemical compound with molecular formula C37H48N4O5 and molecular weight 628.3625 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
N-[5-[[2-(2,6-dimethylphenoxy)acetyl]amino]-4-hydroxy-1,6-diphenylhexan-2-yl]-3-methyl-2-(2-oxo-1,3-diazinan-1-yl)butanamide
Also Known As: Lopinavir, Aluvia, Lopinavir-d8, (2R,4S,5S)-Lopinavir, Lopinavir [USAN:INN:BAN]
| Molecular Formula | C37H48N4O5 |
| Molecular Weight | 628.3625 g/mol |
| XLogP | 5.9 |
| Topological Polar Surface Area (TPSA) | 120.0 Ų |
| Hydrogen Bond Donors | 4 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 15 |
| Exact Mass | 628.3625 Da |
| Heavy Atoms | 46 |
| Complexity | 940.0 |
| SMILES | CC1=C(C(=CC=C1)C)OCC(=O)NC(CC2=CC=CC=C2)C(CC(CC3=CC=CC=C3)NC(=O)C(C(C)C)N4CCCNC4=O)O |
| InChIKey | KJHKTHWMRKYKJE-UHFFFAOYSA-N |
The XLogP value of 5.9 indicates that Lopinavir is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 120.0 Ų falls within the moderate polarity range, balancing permeability and solubility for Lopinavir. Following Lipinski's Rule of Five, Lopinavir has 4 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
The CAS number of Lopinavir is 192725-17-0.
The molecular formula of Lopinavir is C37H48N4O5.
The molecular weight of Lopinavir is 628.3625 g/mol.
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