RefChem:268690
TL;DR: RefChem:268690 (CAS 37126-56-0) is a chemical compound with molecular formula C23H31ClN2O and molecular weight 386.21 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
diethyl-[3-(3-ethyl-2-oxo-3-phenylindol-1-yl)propyl]azanium chloride
Also Known As: 1,3-Dihydro-1-(3-(diethylamino)propyl)-3-ethyl-3-phenyl-2H-indol-2-one hydrochloride, 2H-Indol-2-one, 1,3-dihydro-1-(3-(diethylamino)propyl)-3-ethyl-3-phenyl-, monohydrochloride, diethyl-[3-(3-ethyl-2-oxo-3-phenylindol-1-yl)propyl]azanium chloride, 2H-INDOL-2-ONE, 1,3-DIHYDRO-1-(3-(DIETHYLAMINO)PROPYL)-3-ETHYL-3-PHENYL-, MONOHY, RefChem:268690
| Molecular Formula | C23H31ClN2O |
|---|---|
| Molecular Weight | 386.21 g/mol |
| LogP | 0.05 |
| Topological Polar Surface Area | 24.8 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 8 |
| Exact Mass | 386.2125 |
| Heavy Atoms | 27 |
| Complexity | 455.0 |
Chemical Identifiers
| CAS Number | 37126-56-0 |
|---|---|
| SMILES | CCC1(C2=CC=CC=C2N(C1=O)CCC[NH+](CC)CC)C3=CC=CC=C3.[Cl-] |
| InChIKey | SZOXRUCMBBIGDK-UHFFFAOYSA-N |
Product Overview
RefChem:268690 (CAS 37126-56-0), with molecular formula C23H31ClN2O and molecular weight 386.21 g/mol. IUPAC: diethyl-[3-(3-ethyl-2-oxo-3-phenylindol-1-yl)propyl]azanium chloride.
Chemical Property Profile of RefChem:268690
Property Insights of RefChem:268690
The XLogP value of 0.05 suggests moderate lipophilicity, balancing water solubility and membrane permeability for RefChem:268690. With a topological polar surface area (TPSA) of 24.8 Ų, RefChem:268690 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, RefChem:268690 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:268690?
The CAS number of RefChem:268690 is 37126-56-0.
What is the molecular formula of RefChem:268690?
The molecular formula of RefChem:268690 is C23H31ClN2O.
What is the molecular weight of RefChem:268690?
The molecular weight of RefChem:268690 is 386.21 g/mol.
Where can I buy RefChem:268690?
You can request a quote for RefChem:268690 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for RefChem:268690?
Yes, KEHONG BIO provides custom synthesis services for RefChem:268690 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.