Cepafungin I
TL;DR: Cepafungin I (CAS 130743-08-7) is a chemical compound with molecular formula C28H46N4O6 and molecular weight 534.34174 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
(2E,4E)-N-[(2S,3R)-3-hydroxy-1-[[(3Z,5S,8S,10S)-10-hydroxy-5-methyl-2,7-dioxo-1,6-diazacyclododec-3-en-8-yl]amino]-1-oxobutan-2-yl]-11-methyldodeca-2,4-dienamide
Also Known As: Cepafungin I, (2E,4E)-N-[(2S,3R)-3-hydroxy-1-[[(3Z,5S,8S,10S)-10-hydroxy-5-methyl-2,7-dioxo-1,6-diazacyclododec-3-en-8-yl]amino]-1-oxobutan-2-yl]-11-methyldodeca-2,4-dienamide, 2,4-Dodecadienamide, N-(2-hydroxy-1-(((10-hydroxy-5-methyl-2,7-dioxo-1,6-diazabicyclododec-3-en-8-yl)amino)carbonyl)propyl)-11-methyl-, (5S-(3E,5R*,8R*(1R*(2E,4E),2S*),10R*))-
Technical Specifications
| Molecular Formula | C28H46N4O6 |
| Molecular Weight | 534.34174 g/mol |
| XLogP | 3.4 |
| Topological Polar Surface Area (TPSA) | 157.0 Ų |
| Hydrogen Bond Donors | 6 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 12 |
| Exact Mass | 534.34174 Da |
| Heavy Atoms | 38 |
| Complexity | 854.0 |
| SMILES | C[C@H]1/C=C\C(=O)NCC[C@@H](C[C@@H](C(=O)N1)NC(=O)[C@H]([C@@H](C)O)NC(=O)/C=C/C=C/CCCCCC(C)C)O |
| InChIKey | SVHNVAFCZJDSIW-VBFMYEFXSA-N |
Chemical Property Profile of Cepafungin I
Property Insights of Cepafungin I
The XLogP value of 3.4 indicates that Cepafungin I is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 157.0 Ų indicates high polarity, suggesting Cepafungin I may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, Cepafungin I has 6 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
What is the CAS number of Cepafungin I?
The CAS number of Cepafungin I is 130743-08-7.
What is the molecular formula of Cepafungin I?
The molecular formula of Cepafungin I is C28H46N4O6.
What is the molecular weight of Cepafungin I?
The molecular weight of Cepafungin I is 534.34174 g/mol.
Where can I buy Cepafungin I?
You can request a quote for Cepafungin I directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for Cepafungin I?
Yes, CoreyChem provides custom synthesis services for Cepafungin I and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.