Β-内酰胺酶
TL;DR: Β-内酰胺酶 (CAS 9073-60-3) is a chemical compound with molecular formula C21H17N3O8S3 and molecular weight 535.02 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
Β-内酰胺酶
(6R,7R)-3-[(3-carboxy-4-nitrophenyl)sulfanylmethyl]-8-oxo-7-[(2-thiophen-2-ylacetyl)amino]-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid
Also Known As: CENTA, Ceftazidimase, A-lactamase, beta-lactamas, beta-Lactamase
| Molecular Formula | C21H17N3O8S3 |
|---|---|
| Molecular Weight | 535.02 g/mol |
| LogP | 1.9 |
| Topological Polar Surface Area | 249.0 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 11 |
| Rotatable Bonds | 8 |
| Exact Mass | 535.01776 |
| Heavy Atoms | 35 |
| Complexity | 955.0 |
Chemical Identifiers
| CAS Number | 9073-60-3 |
|---|---|
| SMILES | C1C(=C(N2[C@H](S1)[C@@H](C2=O)NC(=O)CC3=CC=CS3)C(=O)O)CSC4=CC(=C(C=C4)[N+](=O)[O-])C(=O)O |
| InChIKey | PFVWVVUSAORMBB-VQIMIIECSA-N |
Patent-Derived Application Labels
Derived from 3 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Β-内酰胺酶 (CAS 9073-60-3), with molecular formula C21H17N3O8S3 and molecular weight 535.02 g/mol. IUPAC: (6R,7R)-3-[(3-carboxy-4-nitrophenyl)sulfanylmethyl]-8-oxo-7-[(2-thiophen-2-ylacetyl)amino]-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid.
Chemical Property Profile of Β-内酰胺酶
Property Insights of Β-内酰胺酶
The XLogP value of 1.9 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Β-内酰胺酶. The TPSA of 249.0 Ų indicates high polarity, suggesting Β-内酰胺酶 may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, Β-内酰胺酶 has 3 hydrogen bond donor(s) and 11 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Β-内酰胺酶?
The CAS number of Β-内酰胺酶 is 9073-60-3.
What is the molecular formula of Β-内酰胺酶?
The molecular formula of Β-内酰胺酶 is C21H17N3O8S3.
What is the molecular weight of Β-内酰胺酶?
The molecular weight of Β-内酰胺酶 is 535.02 g/mol.
Where can I buy Β-内酰胺酶?
You can request a quote for Β-内酰胺酶 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Β-内酰胺酶?
Yes, KEHONG BIO provides custom synthesis services for Β-内酰胺酶 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.