Penicillin O potassium
TL;DR: Penicillin O potassium (CAS 897-61-0) is a chemical compound with molecular formula C13H18KN2O4S2+ and molecular weight 369.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
potassium (2S,6R)-3,3-dimethyl-7-oxo-6-[(2-prop-2-enylsulfanylacetyl)amino]-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid
Also Known As: Penicillin O potassium, potassium (2S,6R)-3,3-dimethyl-7-oxo-6-[(2-prop-2-enylsulfanylacetyl)amino]-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid
| Molecular Formula | C13H18KN2O4S2+ |
|---|---|
| Molecular Weight | 369.03 g/mol |
| LogP | -2.4587 |
| Topological Polar Surface Area | 86.71 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 6 |
| Exact Mass | 369.03452 |
| Heavy Atoms | 22 |
| Complexity | 500.43176 |
Chemical Identifiers
| CAS Number | 897-61-0 |
|---|---|
| SMILES | CC1([C@@H](N2C(S1)[C@@H](C2=O)NC(=O)CSCC=C)C(=O)O)C.[K+] |
Product Overview
Penicillin O potassium (CAS 897-61-0), with molecular formula C13H18KN2O4S2+ and molecular weight 369.03 g/mol. IUPAC: potassium (2S,6R)-3,3-dimethyl-7-oxo-6-[(2-prop-2-enylsulfanylacetyl)amino]-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid.
Chemical Property Profile of Penicillin O potassium
Property Insights of Penicillin O potassium
The XLogP value of -2.4587 indicates that Penicillin O potassium is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 86.71 Ų falls within the moderate polarity range, balancing permeability and solubility for Penicillin O potassium. Following Lipinski's Rule of Five, Penicillin O potassium has 2 hydrogen bond donor(s) and 5 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 Penicillin O potassium?
The CAS number of Penicillin O potassium is 897-61-0.
What is the molecular formula of Penicillin O potassium?
The molecular formula of Penicillin O potassium is C13H18KN2O4S2+.
What is the molecular weight of Penicillin O potassium?
The molecular weight of Penicillin O potassium is 369.03 g/mol.
Where can I buy Penicillin O potassium?
You can request a quote for Penicillin O potassium directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Penicillin O potassium?
Yes, KEHONG BIO provides custom synthesis services for Penicillin O potassium and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.