GWX2BS8Y4O
TL;DR: GWX2BS8Y4O (CAS 61270-71-1) is a chemical compound with molecular formula C10H12N6O6S3 and molecular weight 408.00 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(6R,7R)-7-amino-8-oxo-3-[[1-(sulfomethyl)tetrazol-5-yl]sulfanylmethyl]-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid
Also Known As: EINECS 262-682-8, 7-ACA-3-SMT, DES(2-hydroxy-2-phenyl-acetyl)cefonicid, (6R,7R)-7-amino-8-oxo-3-[[1-(sulfomethyl)tetrazol-5-yl]sulfanylmethyl]-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid, (6R-trans)-7-Amino-8-oxo-3-(((1-(sulphomethyl)-1H-tetrazol-5-yl)thio)methyl)-5-thia-1-azabicyclo(4.2.0)oct-2-ene-2-carboxylic acid
| Molecular Formula | C10H12N6O6S3 |
|---|---|
| Molecular Weight | 408.00 g/mol |
| LogP | -1.8084 |
| Topological Polar Surface Area | 181.6 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 10 |
| Rotatable Bonds | 6 |
| Exact Mass | 407.99805 |
| Heavy Atoms | 25 |
| Complexity | 866.24695 |
Chemical Identifiers
| CAS Number | 61270-71-1 |
|---|---|
| SMILES | C1C(=C(N2[C@H](S1)[C@@H](C2=O)N)C(=O)O)CSC3=NN=NN3CS(=O)(=O)O |
Product Overview
GWX2BS8Y4O (CAS 61270-71-1), with molecular formula C10H12N6O6S3 and molecular weight 408.00 g/mol. IUPAC: (6R,7R)-7-amino-8-oxo-3-[[1-(sulfomethyl)tetrazol-5-yl]sulfanylmethyl]-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid.
Chemical Property Profile of GWX2BS8Y4O
Property Insights of GWX2BS8Y4O
The XLogP value of -1.8084 indicates that GWX2BS8Y4O is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 181.6 Ų indicates high polarity, suggesting GWX2BS8Y4O may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, GWX2BS8Y4O has 3 hydrogen bond donor(s) and 10 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 GWX2BS8Y4O?
The CAS number of GWX2BS8Y4O is 61270-71-1.
What is the molecular formula of GWX2BS8Y4O?
The molecular formula of GWX2BS8Y4O is C10H12N6O6S3.
What is the molecular weight of GWX2BS8Y4O?
The molecular weight of GWX2BS8Y4O is 408.00 g/mol.
Where can I buy GWX2BS8Y4O?
You can request a quote for GWX2BS8Y4O directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for GWX2BS8Y4O?
Yes, KEHONG BIO provides custom synthesis services for GWX2BS8Y4O and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.