TL;DR: cefotaxime (CAS 63527-52-6) is a chemical compound with molecular formula C16H17N5O7S2 and molecular weight 455.05695 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
3-(acetyloxymethyl)-7-[[2-(2-amino-1,3-thiazol-4-yl)-2-methoxyiminoacetyl]amino]-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid
Also Known As: cefotaxime, Claforan, Cefotaxima, Cefotaximum, Cephotaxime
Top 5 of 2 IPC patent classification(s) from the SureChEMBL global patent database.
| Molecular Formula | C16H17N5O7S2 |
| Molecular Weight | 455.05695 g/mol |
| XLogP | -1.4 |
| Topological Polar Surface Area (TPSA) | 227.0 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 12 |
| Rotatable Bonds | 8 |
| Exact Mass | 455.05695 Da |
| Heavy Atoms | 30 |
| Complexity | 833.0 |
| SMILES | CC(=O)OCC1=C(N2C(C(C2=O)NC(=O)C(=NOC)C3=CSC(=N3)N)SC1)C(=O)O |
| InChIKey | GPRBEKHLDVQUJE-UHFFFAOYSA-N |
The XLogP value of -1.4 indicates that cefotaxime is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 227.0 Ų indicates high polarity, suggesting cefotaxime may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, cefotaxime has 3 hydrogen bond donor(s) and 12 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
The CAS number of cefotaxime is 63527-52-6.
The molecular formula of cefotaxime is C16H17N5O7S2.
The molecular weight of cefotaxime is 455.05695 g/mol.
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