Desethylaprindine
TL;DR: Desethylaprindine (CAS 5672-23-1) is a chemical compound with molecular formula C20H26N2 and molecular weight 294.21 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N'-(2,3-dihydro-1H-inden-2-yl)-N-ethyl-N'-phenylpropane-1,3-diamine
Also Known As: Desethylaprindine, KST-1B5695, KST-1B5698, 1,3-Propanediamine, N-(2,3-dihydro-1H-inden-2-yl)-N'-ethyl-N-phenyl-, N-(
| Molecular Formula | C20H26N2 |
|---|---|
| Molecular Weight | 294.21 g/mol |
| LogP | 4.4 |
| Topological Polar Surface Area | 15.3 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 7 |
| Exact Mass | 294.2096 |
| Heavy Atoms | 22 |
| Complexity | 297.0 |
Chemical Identifiers
| CAS Number | 5672-23-1 |
|---|---|
| SMILES | CCNCCCN(C1CC2=CC=CC=C2C1)C3=CC=CC=C3 |
| InChIKey | JVKNBCGVGGFZLV-UHFFFAOYSA-N |
Product Overview
Desethylaprindine (CAS 5672-23-1), with molecular formula C20H26N2 and molecular weight 294.21 g/mol. IUPAC: N'-(2,3-dihydro-1H-inden-2-yl)-N-ethyl-N'-phenylpropane-1,3-diamine.
Chemical Property Profile of Desethylaprindine
Property Insights of Desethylaprindine
The XLogP value of 4.4 indicates that Desethylaprindine is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 15.3 Ų, Desethylaprindine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Desethylaprindine has 1 hydrogen bond donor(s) and 2 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 Desethylaprindine?
The CAS number of Desethylaprindine is 5672-23-1.
What is the molecular formula of Desethylaprindine?
The molecular formula of Desethylaprindine is C20H26N2.
What is the molecular weight of Desethylaprindine?
The molecular weight of Desethylaprindine is 294.21 g/mol.
Where can I buy Desethylaprindine?
You can request a quote for Desethylaprindine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Desethylaprindine?
Yes, KEHONG BIO provides custom synthesis services for Desethylaprindine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.