Pyrophendane
TL;DR: Pyrophendane (CAS 90434-26-7) is a chemical compound with molecular formula C21H25N and molecular weight 291.20 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-methyl-3-[(3-phenyl-2,3-dihydro-1H-inden-1-yl)methyl]pyrrolidine
Also Known As: Pyrophenindane, PYROPHENDANE, pirofendano, pyrophendanum, Pyrophendane [INN]
| Molecular Formula | C21H25N |
|---|---|
| Molecular Weight | 291.20 g/mol |
| LogP | 4.8 |
| Topological Polar Surface Area | 3.2 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 3 |
| Exact Mass | 291.1987 |
| Heavy Atoms | 22 |
| Complexity | 359.0 |
Chemical Identifiers
| CAS Number | 90434-26-7 |
|---|---|
| SMILES | CN1CCC(C1)CC2CC(C3=CC=CC=C23)C4=CC=CC=C4 |
| InChIKey | AMYOGBYNKSSTIB-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 1 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Pyrophendane (CAS 90434-26-7), with molecular formula C21H25N and molecular weight 291.20 g/mol. IUPAC: 1-methyl-3-[(3-phenyl-2,3-dihydro-1H-inden-1-yl)methyl]pyrrolidine.
Chemical Property Profile of Pyrophendane
Property Insights of Pyrophendane
The XLogP value of 4.8 indicates that Pyrophendane is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 3.2 Ų, Pyrophendane exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Pyrophendane has 0 hydrogen bond donor(s) and 1 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 Pyrophendane?
The CAS number of Pyrophendane is 90434-26-7.
What is the molecular formula of Pyrophendane?
The molecular formula of Pyrophendane is C21H25N.
What is the molecular weight of Pyrophendane?
The molecular weight of Pyrophendane is 291.20 g/mol.
Where can I buy Pyrophendane?
You can request a quote for Pyrophendane directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Pyrophendane?
Yes, KEHONG BIO provides custom synthesis services for Pyrophendane and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.