头孢孟多酯
TL;DR: 头孢孟多酯 (CAS 30034-03-8) is a chemical compound with molecular formula C18H18N6O5S2 and molecular weight 462.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
头孢孟多酯
(6R,7R)-7-[[(2R)-2-hydroxy-2-phenylacetyl]amino]-3-[(1-methyltetrazol-5-yl)sulfanylmethyl]-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid
Also Known As: cefamandole, Cefadole, Cefamandol, Cephadole, CEPHAMANDOLE
| Molecular Formula | C18H18N6O5S2 |
|---|---|
| Molecular Weight | 462.08 g/mol |
| LogP | -0.9 |
| Topological Polar Surface Area | 201.0 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 10 |
| Rotatable Bonds | 7 |
| Exact Mass | 462.078 |
| Heavy Atoms | 31 |
| Complexity | 777.0 |
Chemical Identifiers
| CAS Number | 30034-03-8 |
|---|---|
| SMILES | CN1C(=NN=N1)SCC2=C(N3[C@@H]([C@@H](C3=O)NC(=O)[C@@H](C4=CC=CC=C4)O)SC2)C(=O)O |
| InChIKey | OLVCFLKTBJRLHI-AXAPSJFSSA-N |
Patent-Derived Application Labels
Derived from 18 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
头孢孟多酯 (CAS 30034-03-8), with molecular formula C18H18N6O5S2 and molecular weight 462.08 g/mol. IUPAC: (6R,7R)-7-[[(2R)-2-hydroxy-2-phenylacetyl]amino]-3-[(1-methyltetrazol-5-yl)sulfanylmethyl]-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid.
Chemical Property Profile of 头孢孟多酯
Property Insights of 头孢孟多酯
The XLogP value of -0.9 indicates that 头孢孟多酯 is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 201.0 Ų indicates high polarity, suggesting 头孢孟多酯 may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, 头孢孟多酯 has 3 hydrogen bond donor(s) and 10 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 头孢孟多酯?
The CAS number of 头孢孟多酯 is 30034-03-8.
What is the molecular formula of 头孢孟多酯?
The molecular formula of 头孢孟多酯 is C18H18N6O5S2.
What is the molecular weight of 头孢孟多酯?
The molecular weight of 头孢孟多酯 is 462.08 g/mol.
Where can I buy 头孢孟多酯?
You can request a quote for 头孢孟多酯 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 头孢孟多酯?
Yes, KEHONG BIO provides custom synthesis services for 头孢孟多酯 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.