帕尼培南
TL;DR: 帕尼培南 (CAS 87726-17-8) is a chemical compound with molecular formula C15H21N3O4S and molecular weight 339.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
帕尼培南
3-(1-ethanimidoylpyrrolidin-3-yl)sulfanyl-6-(1-hydroxyethyl)-7-oxo-1-azabicyclo[3.2.0]hept-2-ene-2-carboxylic acid
Also Known As: panipenem, Panipenemum, PANIPENAM, Carbapenem RS-533, Panipenem [INN:JAN]
| Molecular Formula | C15H21N3O4S |
|---|---|
| Molecular Weight | 339.13 g/mol |
| LogP | 0.0 |
| Topological Polar Surface Area | 130.0 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 5 |
| Exact Mass | 339.12527 |
| Heavy Atoms | 23 |
| Complexity | 606.0 |
Chemical Identifiers
| CAS Number | 87726-17-8 |
|---|---|
| SMILES | CC(C1C2CC(=C(N2C1=O)C(=O)O)SC3CCN(C3)C(=N)C)O |
| InChIKey | TYMABNNERDVXID-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 1 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
帕尼培南 (CAS 87726-17-8), with molecular formula C15H21N3O4S and molecular weight 339.13 g/mol. IUPAC: 3-(1-ethanimidoylpyrrolidin-3-yl)sulfanyl-6-(1-hydroxyethyl)-7-oxo-1-azabicyclo[3.2.0]hept-2-ene-2-carboxylic acid.
Chemical Property Profile of 帕尼培南
Property Insights of 帕尼培南
The XLogP value of 0.0 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 帕尼培南. The TPSA of 130.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 帕尼培南. Following Lipinski's Rule of Five, 帕尼培南 has 3 hydrogen bond donor(s) and 6 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 帕尼培南?
The CAS number of 帕尼培南 is 87726-17-8.
What is the molecular formula of 帕尼培南?
The molecular formula of 帕尼培南 is C15H21N3O4S.
What is the molecular weight of 帕尼培南?
The molecular weight of 帕尼培南 is 339.13 g/mol.
Where can I buy 帕尼培南?
You can request a quote for 帕尼培南 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 帕尼培南?
Yes, KEHONG BIO provides custom synthesis services for 帕尼培南 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.