TL;DR: Lapatinib (CAS 1092929-10-6) is a chemical compound with molecular formula C29H26ClFN4O4S and molecular weight 580.1347 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
N-[3-chloro-4-[(3-fluorophenyl)methoxy]phenyl]-6-[5-[(2-methylsulfonylethylamino)methyl]furan-2-yl]quinazolin-4-amine
Also Known As: Lapatinib, Tykerb, Lapatinib Ditosylate, Tyverb, Tycerb
Top 5 of 7 IPC patent classification(s) from the SureChEMBL global patent database.
| Molecular Formula | C29H26ClFN4O4S |
| Molecular Weight | 580.1347 g/mol |
| XLogP | 5.1 |
| Topological Polar Surface Area (TPSA) | 115.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 9 |
| Rotatable Bonds | 11 |
| Exact Mass | 580.1347 Da |
| Heavy Atoms | 40 |
| Complexity | 898.0 |
| SMILES | CS(=O)(=O)CCNCC1=CC=C(O1)C2=CC3=C(C=C2)N=CN=C3NC4=CC(=C(C=C4)OCC5=CC(=CC=C5)F)Cl |
| InChIKey | BCFGMOOMADDAQU-UHFFFAOYSA-N |
The XLogP value of 5.1 indicates that Lapatinib is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 115.0 Ų falls within the moderate polarity range, balancing permeability and solubility for Lapatinib. Following Lipinski's Rule of Five, Lapatinib has 2 hydrogen bond donor(s) and 9 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
The CAS number of Lapatinib is 1092929-10-6.
The molecular formula of Lapatinib is C29H26ClFN4O4S.
The molecular weight of Lapatinib is 580.1347 g/mol.
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