CHEMICAL AND PHYSICAL PROPERTIES
| Physical Description | Solid |
|---|---|
| Melting Point | 182-184 |
| Solubility | 5.81e-01 g/L |
| LogP | 0.5 |
| Dissociation Constants | 3.4 |
| Collision Cross Section | 197.9 Ų [M+Na]+ [CCS Type: TW, Method: calibrated with Waters Major Mix] |
COMPUTED DESCRIPTORS
| Molecular Weight | 462.5 g/mol |
|---|---|
| XLogP3 | -0.9 |
| Hydrogen Bond Donor Count | 3 |
| Hydrogen Bond Acceptor Count | 10 |
| Rotatable Bond Count | 7 |
| Exact Mass | 462.07801004 g/mol |
| Monoisotopic Mass | 462.07801004 g/mol |
| Topological Polar Surface Area | 201 Ų |
| Heavy Atom Count | 31 |
| Formal Charge | 0 |
| Complexity | 777 |
| Isotope Atom Count | 0 |
| Defined Atom Stereocenter Count | 3 |
| Undefined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| Covalently-Bonded Unit Count | 1 |
| Compound Is Canonicalized | Yes |
PRODUCT INTRODUCTION
description
Cefamandole is a cephalosporin compound having (R)-mandelamido and N-methylthiotetrazole side-groups. It has a role as an antibacterial drug. It is a cephalosporin and a semisynthetic derivative. It is a conjugate acid of a cefamandole(1-).