Cefditoren Pivoxil
TL;DR: Cefditoren Pivoxil (CAS 117482-75-4) is a chemical compound with molecular formula C25H28N6O7S3 and molecular weight 620.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2,2-dimethylpropanoyloxymethyl (6R,7R)-7-[[(2Z)-2-(2-amino-1,3-thiazol-4-yl)-2-methoxyiminoacetyl]amino]-3-[(Z)-2-(4-methyl-1,3-thiazol-5-yl)ethenyl]-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylate
Also Known As: cefditoren pivoxil, Spectracef, Meiact, Cefditorin, CDTR-PI
| Molecular Formula | C25H28N6O7S3 |
|---|---|
| Molecular Weight | 620.12 g/mol |
| LogP | 2.29812 |
| Topological Polar Surface Area | 175.4 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 14 |
| Rotatable Bonds | 9 |
| Exact Mass | 620.11816 |
| Heavy Atoms | 41 |
| Complexity | 1455.2561 |
Chemical Identifiers
| CAS Number | 117482-75-4 |
|---|---|
| SMILES | CC1=C(SC=N1)/C=C\C2=C(N3[C@@H]([C@@H](C3=O)NC(=O)/C(=N\OC)/C4=CSC(=N4)N)SC2)C(=O)OCOC(=O)C(C)(C)C |
Product Overview
Cefditoren Pivoxil (CAS 117482-75-4), with molecular formula C25H28N6O7S3 and molecular weight 620.12 g/mol. IUPAC: 2,2-dimethylpropanoyloxymethyl (6R,7R)-7-[[(2Z)-2-(2-amino-1,3-thiazol-4-yl)-2-methoxyiminoacetyl]amino]-3-[(Z)-2-(4-methyl-1,3-thiazol-5-yl)ethenyl]-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylate.
Chemical Property Profile of Cefditoren Pivoxil
Property Insights of Cefditoren Pivoxil
The XLogP value of 2.29812 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Cefditoren Pivoxil. The TPSA of 175.4 Ų indicates high polarity, suggesting Cefditoren Pivoxil may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, Cefditoren Pivoxil has 2 hydrogen bond donor(s) and 14 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Cefditoren Pivoxil?
The CAS number of Cefditoren Pivoxil is 117482-75-4.
What is the molecular formula of Cefditoren Pivoxil?
The molecular formula of Cefditoren Pivoxil is C25H28N6O7S3.
What is the molecular weight of Cefditoren Pivoxil?
The molecular weight of Cefditoren Pivoxil is 620.12 g/mol.
Where can I buy Cefditoren Pivoxil?
You can request a quote for Cefditoren Pivoxil directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Cefditoren Pivoxil?
Yes, KEHONG BIO provides custom synthesis services for Cefditoren Pivoxil and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.