RefChem:268692
TL;DR: RefChem:268692 (CAS 37126-55-9) is a chemical compound with molecular formula C21H27ClN2O and molecular weight 358.18 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-(3-ethyl-2-oxo-3-phenylindol-1-yl)propyl-dimethylazanium chloride
Also Known As: 1,3-Dihydro-1-(3-(dimethylamino)propyl)-3-ethyl-3-phenyl-2H-indol-2-one hydrochloride, 2H-Indol-2-one, 1,3-dihydro-1-(3-(dimethylamino)propyl)-3-ethyl-3-phenyl-, monohydrochloride, 3-(3-ethyl-2-oxo-3-phenylindol-1-yl)propyl-dimethylazanium chloride, 2H-INDOL-2-ONE, 1,3-DIHYDRO-1-(3-(DIMETHYLAMINO)PROPYL)-3-ETHYL-3-PHENYL-, MONOH, RefChem:268692
| Molecular Formula | C21H27ClN2O |
|---|---|
| Molecular Weight | 358.18 g/mol |
| LogP | -0.73 |
| Topological Polar Surface Area | 24.8 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 6 |
| Exact Mass | 358.18118 |
| Heavy Atoms | 25 |
| Complexity | 430.0 |
Chemical Identifiers
| CAS Number | 37126-55-9 |
|---|---|
| SMILES | CCC1(C2=CC=CC=C2N(C1=O)CCC[NH+](C)C)C3=CC=CC=C3.[Cl-] |
| InChIKey | XPHCYFLGLROFHF-UHFFFAOYSA-N |
Product Overview
RefChem:268692 (CAS 37126-55-9), with molecular formula C21H27ClN2O and molecular weight 358.18 g/mol. IUPAC: 3-(3-ethyl-2-oxo-3-phenylindol-1-yl)propyl-dimethylazanium chloride.
Chemical Property Profile of RefChem:268692
Property Insights of RefChem:268692
The XLogP value of -0.73 indicates that RefChem:268692 is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. With a topological polar surface area (TPSA) of 24.8 Ų, RefChem:268692 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, RefChem:268692 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 RefChem:268692?
The CAS number of RefChem:268692 is 37126-55-9.
What is the molecular formula of RefChem:268692?
The molecular formula of RefChem:268692 is C21H27ClN2O.
What is the molecular weight of RefChem:268692?
The molecular weight of RefChem:268692 is 358.18 g/mol.
Where can I buy RefChem:268692?
You can request a quote for RefChem:268692 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for RefChem:268692?
Yes, KEHONG BIO provides custom synthesis services for RefChem:268692 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.