Cefditoren
TL;DR: Cefditoren (CAS 104145-95-1) is a chemical compound with molecular formula C19H18N6O5S3 and molecular weight 506.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(6R,7R)-7-[[(2Z)-2-(2-amino-1,3-thiazol-4-yl)-2-methoxyiminoacetyl]amino]-3-[2-(4-methyl-1,3-thiazol-5-yl)ethenyl]-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid
Also Known As: Cefditoren
| Molecular Formula | C19H18N6O5S3 |
|---|---|
| Molecular Weight | 506.05 g/mol |
| LogP | 1.29272 |
| Topological Polar Surface Area | 160.1 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 11 |
| Rotatable Bonds | 7 |
| Exact Mass | 506.05008 |
| Heavy Atoms | 33 |
| Complexity | 1216.119 |
Chemical Identifiers
| CAS Number | 104145-95-1 |
|---|---|
| SMILES | CC1=C(SC=N1)C=CC2=C(N3[C@@H]([C@@H](C3=O)NC(=O)/C(=N\OC)/C4=CSC(=N4)N)SC2)C(=O)O |
Product Overview
Cefditoren (CAS 104145-95-1), with molecular formula C19H18N6O5S3 and molecular weight 506.05 g/mol. IUPAC: (6R,7R)-7-[[(2Z)-2-(2-amino-1,3-thiazol-4-yl)-2-methoxyiminoacetyl]amino]-3-[2-(4-methyl-1,3-thiazol-5-yl)ethenyl]-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid.
Chemical Property Profile of Cefditoren
Property Insights of Cefditoren
The XLogP value of 1.29272 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Cefditoren. The TPSA of 160.1 Ų indicates high polarity, suggesting Cefditoren may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, Cefditoren has 3 hydrogen bond donor(s) and 11 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Cefditoren?
The CAS number of Cefditoren is 104145-95-1.
What is the molecular formula of Cefditoren?
The molecular formula of Cefditoren is C19H18N6O5S3.
What is the molecular weight of Cefditoren?
The molecular weight of Cefditoren is 506.05 g/mol.
Where can I buy Cefditoren?
You can request a quote for Cefditoren directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Cefditoren?
Yes, KEHONG BIO provides custom synthesis services for Cefditoren and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.