Etoprindole
TL;DR: Etoprindole (CAS 54063-37-5) is a chemical compound with molecular formula C15H21N3O and molecular weight 259.17 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[1-[1-[2-(dimethylamino)ethyl]indol-3-yl]propylidene]hydroxylamine
Also Known As: Etoprindole, etoprindol, etoprindolum, Etoprindole [INN:DCF], ETOPRINDOLE [INN]
| Molecular Formula | C15H21N3O |
|---|---|
| Molecular Weight | 259.17 g/mol |
| LogP | 2.4 |
| Topological Polar Surface Area | 40.8 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 5 |
| Exact Mass | 259.16846 |
| Heavy Atoms | 19 |
| Complexity | 317.0 |
Chemical Identifiers
| CAS Number | 54063-37-5 |
|---|---|
| SMILES | CCC(=NO)C1=CN(C2=CC=CC=C21)CCN(C)C |
| InChIKey | PNWRDBWQKOXCMK-UHFFFAOYSA-N |
Product Overview
Etoprindole (CAS 54063-37-5), with molecular formula C15H21N3O and molecular weight 259.17 g/mol. IUPAC: N-[1-[1-[2-(dimethylamino)ethyl]indol-3-yl]propylidene]hydroxylamine.
Chemical Property Profile of Etoprindole
Property Insights of Etoprindole
The XLogP value of 2.4 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Etoprindole. With a topological polar surface area (TPSA) of 40.8 Ų, Etoprindole exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Etoprindole has 1 hydrogen bond donor(s) and 3 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 Etoprindole?
The CAS number of Etoprindole is 54063-37-5.
What is the molecular formula of Etoprindole?
The molecular formula of Etoprindole is C15H21N3O.
What is the molecular weight of Etoprindole?
The molecular weight of Etoprindole is 259.17 g/mol.
Where can I buy Etoprindole?
You can request a quote for Etoprindole directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Etoprindole?
Yes, KEHONG BIO provides custom synthesis services for Etoprindole and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.