Pralnacasan
TL;DR: Pralnacasan (CAS 192755-52-5) is a chemical compound with molecular formula C26H29N5O7 and molecular weight 523.21 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(4S,7S)-N-[(2R,3S)-2-ethoxy-5-oxooxolan-3-yl]-7-(isoquinoline-1-carbonylamino)-6,10-dioxo-2,3,4,7,8,9-hexahydro-1H-pyridazino[1,2-a]diazepine-4-carboxamide
Also Known As: Pralnacasan, pralnacasanum, Pralnacasan [INN], Pralnacasan [USAN:INN], Pralnacasan (USAN/INN)
| Molecular Formula | C26H29N5O7 |
|---|---|
| Molecular Weight | 523.21 g/mol |
| LogP | 0.9 |
| Topological Polar Surface Area | 147.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 6 |
| Exact Mass | 523.2067 |
| Heavy Atoms | 38 |
| Complexity | 960.0 |
Chemical Identifiers
| CAS Number | 192755-52-5 |
|---|---|
| SMILES | CCO[C@H]1[C@H](CC(=O)O1)NC(=O)[C@@H]2CCCN3N2C(=O)[C@H](CCC3=O)NC(=O)C4=NC=CC5=CC=CC=C54 |
| InChIKey | CXAGHAZMQSCAKJ-WAHHBDPQSA-N |
Patent-Derived Application Labels
Derived from 6 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Pralnacasan (CAS 192755-52-5), with molecular formula C26H29N5O7 and molecular weight 523.21 g/mol. IUPAC: (4S,7S)-N-[(2R,3S)-2-ethoxy-5-oxooxolan-3-yl]-7-(isoquinoline-1-carbonylamino)-6,10-dioxo-2,3,4,7,8,9-hexahydro-1H-pyridazino[1,2-a]diazepine-4-carboxamide.
Chemical Property Profile of Pralnacasan
Property Insights of Pralnacasan
The XLogP value of 0.9 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Pralnacasan. The TPSA of 147.0 Ų indicates high polarity, suggesting Pralnacasan may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, Pralnacasan has 2 hydrogen bond donor(s) and 8 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Pralnacasan?
The CAS number of Pralnacasan is 192755-52-5.
What is the molecular formula of Pralnacasan?
The molecular formula of Pralnacasan is C26H29N5O7.
What is the molecular weight of Pralnacasan?
The molecular weight of Pralnacasan is 523.21 g/mol.
Where can I buy Pralnacasan?
You can request a quote for Pralnacasan directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Pralnacasan?
Yes, KEHONG BIO provides custom synthesis services for Pralnacasan and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.