Prothidium
TL;DR: Prothidium (CAS 1406-07-1) is a chemical compound with molecular formula C32H34CaN4O8S2 and molecular weight 706.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
calcium bis(3,3-dimethyl-7-oxo-6-[(2-phenylacetyl)amino]-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylate)
Also Known As: Prothidium, Penicillin calcium, Calcium pencillin, Pyritidii bromidum, Pyritidium Bromide
| Molecular Formula | C32H34CaN4O8S2 |
|---|---|
| Molecular Weight | 706.14 g/mol |
| LogP | -1.33 |
| Topological Polar Surface Area | 230.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 10 |
| Rotatable Bonds | 6 |
| Exact Mass | 706.1444 |
| Heavy Atoms | 47 |
| Complexity | 525.0 |
Chemical Identifiers
| CAS Number | 1406-07-1 |
|---|---|
| SMILES | CC1(C(N2C(S1)C(C2=O)NC(=O)CC3=CC=CC=C3)C(=O)[O-])C.CC1(C(N2C(S1)C(C2=O)NC(=O)CC3=CC=CC=C3)C(=O)[O-])C.[Ca+2] |
| InChIKey | PEWXRXAGXPYMIB-UHFFFAOYSA-L |
Product Overview
Prothidium (CAS 1406-07-1), with molecular formula C32H34CaN4O8S2 and molecular weight 706.14 g/mol. IUPAC: calcium bis(3,3-dimethyl-7-oxo-6-[(2-phenylacetyl)amino]-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylate).
Chemical Property Profile of Prothidium
Property Insights of Prothidium
The XLogP value of -1.33 indicates that Prothidium is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 230.0 Ų indicates high polarity, suggesting Prothidium may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, Prothidium has 2 hydrogen bond donor(s) and 10 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Prothidium?
The CAS number of Prothidium is 1406-07-1.
What is the molecular formula of Prothidium?
The molecular formula of Prothidium is C32H34CaN4O8S2.
What is the molecular weight of Prothidium?
The molecular weight of Prothidium is 706.14 g/mol.
Where can I buy Prothidium?
You can request a quote for Prothidium directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Prothidium?
Yes, KEHONG BIO provides custom synthesis services for Prothidium and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.