Cefotiam Hydrochloride
TL;DR: Cefotiam Hydrochloride (CAS 66309-69-1) is a chemical compound with molecular formula C18H25Cl2N9O4S3 and molecular weight 597.0569 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
(6R,7R)-7-[[2-(2-amino-1,3-thiazol-4-yl)acetyl]amino]-3-[[1-[2-(dimethylamino)ethyl]tetrazol-5-yl]sulfanylmethyl]-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid;dihydrochloride
Also Known As: Cefotiam dihydrochloride, CEFOTIAM HYDROCHLORIDE, Cefotiam hcl, Halospor, Ceradon
Application Areas
Top 5 of 11 IPC patent classification(s) from the SureChEMBL global patent database.
Technical Specifications
| Molecular Formula | C18H25Cl2N9O4S3 |
| Molecular Weight | 597.0569 g/mol |
| XLogP | 0.19 |
| Topological Polar Surface Area (TPSA) | 251.0 Ų |
| Hydrogen Bond Donors | 5 |
| Hydrogen Bond Acceptors | 13 |
| Rotatable Bonds | 10 |
| Exact Mass | 597.0569 Da |
| Heavy Atoms | 36 |
| Complexity | 847.0 |
| SMILES | CN(C)CCN1C(=NN=N1)SCC2=C(N3[C@@H]([C@@H](C3=O)NC(=O)CC4=CSC(=N4)N)SC2)C(=O)O.Cl.Cl |
| InChIKey | BWRRTAXZCKVRON-DGPOFWGLSA-N |
Chemical Property Profile of Cefotiam Hydrochloride
Property Insights of Cefotiam Hydrochloride
The XLogP value of 0.19 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Cefotiam Hydrochloride. The TPSA of 251.0 Ų indicates high polarity, suggesting Cefotiam Hydrochloride may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, Cefotiam Hydrochloride has 5 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 Cefotiam Hydrochloride?
The CAS number of Cefotiam Hydrochloride is 66309-69-1.
What is the molecular formula of Cefotiam Hydrochloride?
The molecular formula of Cefotiam Hydrochloride is C18H25Cl2N9O4S3.
What is the molecular weight of Cefotiam Hydrochloride?
The molecular weight of Cefotiam Hydrochloride is 597.0569 g/mol.
Where can I buy Cefotiam Hydrochloride?
You can request a quote for Cefotiam Hydrochloride directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for Cefotiam Hydrochloride?
Yes, CoreyChem provides custom synthesis services for Cefotiam Hydrochloride and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.