RefChem:268707
TL;DR: RefChem:268707 (CAS 37129-54-7) 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.
ethyl-[3-(3-ethyl-2-oxo-3-phenylindol-1-yl)propyl]azanium chloride
Also Known As: 1,3-Dihydro-3-ethyl-1-(3-(ethylamino)propyl)-3-phenyl-2H-indol-2-one hydrochloride, 2H-Indol-2-one, 1,3-dihydro-3-ethyl-1-(3-(ethylamino)propyl)-3-phenyl-, monohydrochloride, ethyl-[3-(3-ethyl-2-oxo-3-phenylindol-1-yl)propyl]azanium chloride, 2H-INDOL-2-ONE, 1,3-DIHYDRO-3-ETHYL-1-(3-(ETHYLAMINO)PROPYL)-3-PHENYL-, MONOHYDR, RefChem:268707
| Molecular Formula | C21H27ClN2O |
|---|---|
| Molecular Weight | 358.18 g/mol |
| LogP | -0.29 |
| Topological Polar Surface Area | 36.9 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 7 |
| Exact Mass | 358.18118 |
| Heavy Atoms | 25 |
| Complexity | 418.0 |
Chemical Identifiers
| CAS Number | 37129-54-7 |
|---|---|
| SMILES | CCC1(C2=CC=CC=C2N(C1=O)CCC[NH2+]CC)C3=CC=CC=C3.[Cl-] |
| InChIKey | UNAKBFVVJKBKFO-UHFFFAOYSA-N |
Product Overview
RefChem:268707 (CAS 37129-54-7), with molecular formula C21H27ClN2O and molecular weight 358.18 g/mol. IUPAC: ethyl-[3-(3-ethyl-2-oxo-3-phenylindol-1-yl)propyl]azanium chloride.
Chemical Property Profile of RefChem:268707
Property Insights of RefChem:268707
The XLogP value of -0.29 indicates that RefChem:268707 is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. With a topological polar surface area (TPSA) of 36.9 Ų, RefChem:268707 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, RefChem:268707 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:268707?
The CAS number of RefChem:268707 is 37129-54-7.
What is the molecular formula of RefChem:268707?
The molecular formula of RefChem:268707 is C21H27ClN2O.
What is the molecular weight of RefChem:268707?
The molecular weight of RefChem:268707 is 358.18 g/mol.
Where can I buy RefChem:268707?
You can request a quote for RefChem:268707 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for RefChem:268707?
Yes, KEHONG BIO provides custom synthesis services for RefChem:268707 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.