Cephradine Dihydrate
TL;DR: Cephradine Dihydrate (CAS 31828-50-9) is a chemical compound with molecular formula C16H23N3O6S and molecular weight 385.13077 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
(6R,7R)-7-[[(2R)-2-amino-2-cyclohexa-1,4-dien-1-ylacetyl]amino]-3-methyl-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid;dihydrate
Also Known As: Cephradine dihydrate, Cefradin hydrate, cephradine, Velosef hydrate, Sefril hydrate
Application Areas
Top 5 of 4 IPC patent classification(s) from the SureChEMBL global patent database.
Technical Specifications
| Molecular Formula | C16H23N3O6S |
| Molecular Weight | 385.13077 g/mol |
| XLogP | -1.3 |
| Topological Polar Surface Area (TPSA) | 140.0 Ų |
| Hydrogen Bond Donors | 5 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 4 |
| Exact Mass | 385.13077 Da |
| Heavy Atoms | 26 |
| Complexity | 697.0 |
| SMILES | CC1=C(N2[C@@H]([C@@H](C2=O)NC(=O)[C@@H](C3=CCC=CC3)N)SC1)C(=O)O.O.O |
| InChIKey | HBKDHIDYMXXJLI-OEDJVVDHSA-N |
Chemical Property Profile of Cephradine Dihydrate
Property Insights of Cephradine Dihydrate
The XLogP value of -1.3 indicates that Cephradine Dihydrate is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 140.0 Ų indicates high polarity, suggesting Cephradine Dihydrate may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, Cephradine Dihydrate has 5 hydrogen bond donor(s) and 8 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of Cephradine Dihydrate?
The CAS number of Cephradine Dihydrate is 31828-50-9.
What is the molecular formula of Cephradine Dihydrate?
The molecular formula of Cephradine Dihydrate is C16H23N3O6S.
What is the molecular weight of Cephradine Dihydrate?
The molecular weight of Cephradine Dihydrate is 385.13077 g/mol.
Where can I buy Cephradine Dihydrate?
You can request a quote for Cephradine Dihydrate directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for Cephradine Dihydrate?
Yes, CoreyChem provides custom synthesis services for Cephradine Dihydrate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.