Benzylpenicilloyl G
TL;DR: Benzylpenicilloyl G (CAS 2642-55-9) is a chemical compound with molecular formula C22H31N3O6S and molecular weight 465.19 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[2-(5-carboxypentylamino)-2-oxo-1-[(2-phenylacetyl)amino]ethyl]-5,5-dimethyl-1,3-thiazolidine-4-carboxylic acid
Also Known As: Benzylpenicilloyl G, Benzylpenicilloyl, Pre-pen, Benzylpenicilloyl polylysine, Penicilloyl-polylysine
| Molecular Formula | C22H31N3O6S |
|---|---|
| Molecular Weight | 465.19 g/mol |
| LogP | -0.8 |
| Topological Polar Surface Area | 170.0 Ų |
| Hydrogen Bond Donors | 5 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 12 |
| Exact Mass | 465.19336 |
| Heavy Atoms | 32 |
| Complexity | 681.0 |
Chemical Identifiers
| CAS Number | 2642-55-9 |
|---|---|
| SMILES | CC1(C(NC(S1)C(C(=O)NCCCCCC(=O)O)NC(=O)CC2=CC=CC=C2)C(=O)O)C |
| InChIKey | KJABUVRFCPPJPD-UHFFFAOYSA-N |
Product Overview
Benzylpenicilloyl G (CAS 2642-55-9), with molecular formula C22H31N3O6S and molecular weight 465.19 g/mol. IUPAC: 2-[2-(5-carboxypentylamino)-2-oxo-1-[(2-phenylacetyl)amino]ethyl]-5,5-dimethyl-1,3-thiazolidine-4-carboxylic acid.
Chemical Property Profile of Benzylpenicilloyl G
Property Insights of Benzylpenicilloyl G
The XLogP value of -0.8 indicates that Benzylpenicilloyl G is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 170.0 Ų indicates high polarity, suggesting Benzylpenicilloyl G may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, Benzylpenicilloyl G has 5 hydrogen bond donor(s) and 8 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 Benzylpenicilloyl G?
The CAS number of Benzylpenicilloyl G is 2642-55-9.
What is the molecular formula of Benzylpenicilloyl G?
The molecular formula of Benzylpenicilloyl G is C22H31N3O6S.
What is the molecular weight of Benzylpenicilloyl G?
The molecular weight of Benzylpenicilloyl G is 465.19 g/mol.
Where can I buy Benzylpenicilloyl G?
You can request a quote for Benzylpenicilloyl G directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Benzylpenicilloyl G?
Yes, KEHONG BIO provides custom synthesis services for Benzylpenicilloyl G and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.