Cefluprenam
TL;DR: Cefluprenam (CAS 116853-25-9) is a chemical compound with molecular formula C20H25FN8O6S2 and molecular weight 556.13226 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
3-[3-[(2-amino-2-oxoethyl)-ethyl-methylazaniumyl]prop-1-enyl]-7-[[2-(5-amino-1,2,4-thiadiazol-3-yl)-2-(fluoromethoxyimino)acetyl]amino]-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylate
Also Known As: Cefluprenam, 2-Propen-1-aminium, N-(2-amino-2-oxoethyl)-3-[(6R,7R)-7-[[(2Z)-2-(5-amino-1,2,4-thiadiazol-3-yl)-2-[(fluoromethoxy)imino]acetyl]amino]-2-carboxy-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-en-3-yl]-N-ethyl-N-methyl-, inner salt, (2E)-, 3-[3-[(2-amino-2-oxoethyl)-ethyl-methylazaniumyl]prop-1-enyl]-7-[[2-(5-amino-1,2,4-thiadiazol-3-yl)-2-(fluoromethoxyimino)acetyl]amino]-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylate
Technical Specifications
| Molecular Formula | C20H25FN8O6S2 |
| Molecular Weight | 556.13226 g/mol |
| XLogP | 0.8 |
| Topological Polar Surface Area (TPSA) | 260.0 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 13 |
| Rotatable Bonds | 11 |
| Exact Mass | 556.13226 Da |
| Heavy Atoms | 37 |
| Complexity | 1040.0 |
| SMILES | CC[N+](C)(CC=CC1=C(N2C(C(C2=O)NC(=O)C(=NOCF)C3=NSC(=N3)N)SC1)C(=O)[O-])CC(=O)N |
| InChIKey | XAKKNLNAJBNLPC-UHFFFAOYSA-N |
Chemical Property Profile of Cefluprenam
Property Insights of Cefluprenam
The XLogP value of 0.8 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Cefluprenam. The TPSA of 260.0 Ų indicates high polarity, suggesting Cefluprenam may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, Cefluprenam has 3 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 Cefluprenam?
The CAS number of Cefluprenam is 116853-25-9.
What is the molecular formula of Cefluprenam?
The molecular formula of Cefluprenam is C20H25FN8O6S2.
What is the molecular weight of Cefluprenam?
The molecular weight of Cefluprenam is 556.13226 g/mol.
Where can I buy Cefluprenam?
You can request a quote for Cefluprenam directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for Cefluprenam?
Yes, CoreyChem provides custom synthesis services for Cefluprenam and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.