Vinflunine
TL;DR: Vinflunine (CAS 162652-95-1) is a chemical compound with molecular formula C45H54F2N4O8 and molecular weight 816.391 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
methyl (1R,9R,10S,11R,12R,19R)-11-acetyloxy-4-[(12S,14S,16S)-16-(1,1-difluoroethyl)-12-methoxycarbonyl-1,10-diazatetracyclo[12.3.1.03,11.04,9]octadeca-3(11),4,6,8-tetraen-12-yl]-12-ethyl-10-hydroxy-5-methoxy-8-methyl-8,16-diazapentacyclo[10.6.1.01,9.02,7.016,19]nonadeca-2,4,6,13-tetraene-10-carboxylate
Also Known As: Vinflunine, Javlor, Vinflunine [INN], Vinflunine [INN}, Vinflunine [INN:BAN]
Application Areas
Top 5 of 2 IPC patent classification(s) from the SureChEMBL global patent database.
Technical Specifications
| Molecular Formula | C45H54F2N4O8 |
| Molecular Weight | 816.391 g/mol |
| XLogP | 4.4 |
| Topological Polar Surface Area (TPSA) | 134.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 13 |
| Rotatable Bonds | 10 |
| Exact Mass | 816.391 Da |
| Heavy Atoms | 59 |
| Complexity | 1720.0 |
| SMILES | CC[C@@]12C=CCN3[C@@H]1[C@]4(CC3)[C@H]([C@]([C@@H]2OC(=O)C)(C(=O)OC)O)N(C5=CC(=C(C=C45)[C@]6(C[C@@H]7C[C@@H](CN(C7)CC8=C6NC9=CC=CC=C89)C(C)(F)F)C(=O)OC)OC)C |
| InChIKey | NMDYYWFGPIMTKO-ZSRSGXGDSA-N |
Chemical Property Profile of Vinflunine
Property Insights of Vinflunine
The XLogP value of 4.4 indicates that Vinflunine is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 134.0 Ų falls within the moderate polarity range, balancing permeability and solubility for Vinflunine. Following Lipinski's Rule of Five, Vinflunine has 2 hydrogen bond donor(s) and 13 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
What is the CAS number of Vinflunine?
The CAS number of Vinflunine is 162652-95-1.
What is the molecular formula of Vinflunine?
The molecular formula of Vinflunine is C45H54F2N4O8.
What is the molecular weight of Vinflunine?
The molecular weight of Vinflunine is 816.391 g/mol.
Where can I buy Vinflunine?
You can request a quote for Vinflunine directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for Vinflunine?
Yes, CoreyChem provides custom synthesis services for Vinflunine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.