Penicin
TL;DR: Penicin (CAS 21794-93-4) is a chemical compound with molecular formula C8H12N2O3S and molecular weight 216.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(2S,5R,6S)-6-amino-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid
Also Known As: Penicin, (2S,5R,6S)-6-Amino-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid
| Molecular Formula | C8H12N2O3S |
|---|---|
| Molecular Weight | 216.06 g/mol |
| LogP | -0.5394 |
| Topological Polar Surface Area | 83.63 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 1 |
| Exact Mass | 216.05687 |
| Heavy Atoms | 14 |
| Complexity | 317.70825 |
Chemical Identifiers
| CAS Number | 21794-93-4 |
|---|---|
| SMILES | CC1([C@@H](N2[C@H](S1)[C@H](C2=O)N)C(=O)O)C |
Product Overview
Penicin (CAS 21794-93-4), with molecular formula C8H12N2O3S and molecular weight 216.06 g/mol. IUPAC: (2S,5R,6S)-6-amino-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid.
Chemical Property Profile of Penicin
Property Insights of Penicin
The XLogP value of -0.5394 indicates that Penicin is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 83.63 Ų falls within the moderate polarity range, balancing permeability and solubility for Penicin. Following Lipinski's Rule of Five, Penicin has 2 hydrogen bond donor(s) and 4 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 Penicin?
The CAS number of Penicin is 21794-93-4.
What is the molecular formula of Penicin?
The molecular formula of Penicin is C8H12N2O3S.
What is the molecular weight of Penicin?
The molecular weight of Penicin is 216.06 g/mol.
Where can I buy Penicin?
You can request a quote for Penicin directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Penicin?
Yes, KEHONG BIO provides custom synthesis services for Penicin and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.