RefChem:262072
TL;DR: RefChem:262072 (CAS 33456-27-8) is a chemical compound with molecular formula C28H34ClN3O and molecular weight 463.24 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-[1-[benzyl(ethyl)amino]-2-oxo-3-phenylindol-3-yl]propyl-dimethylazanium chloride
Also Known As: 1-(Benzylethylamino)-3-(3-(dimethylamino)propyl)-3-phenyl-2-indolinone hydrochloride, 2-Indolinone, 1-(benzylethylamino)-3-(3-(dimethylamino)propyl)-3-phenyl-, monohydrochloride, 3-[1-[benzyl(ethyl)amino]-2-oxo-3-phenylindol-3-yl]propyl-dimethylazanium chloride, 2-INDOLINONE, 1-(BENZYLETHYLAMINO)-3-(3-(DIMETHYLAMINO)PROPYL)-3-PHENYL-, MONOHY, RefChem:262072
| Molecular Formula | C28H34ClN3O |
|---|---|
| Molecular Weight | 463.24 g/mol |
| LogP | 0.69 |
| Topological Polar Surface Area | 28.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 9 |
| Exact Mass | 463.23904 |
| Heavy Atoms | 33 |
| Complexity | 595.0 |
Chemical Identifiers
| CAS Number | 33456-27-8 |
|---|---|
| SMILES | CCN(CC1=CC=CC=C1)N2C3=CC=CC=C3C(C2=O)(CCC[NH+](C)C)C4=CC=CC=C4.[Cl-] |
| InChIKey | CBZTWGIUSIBDHB-UHFFFAOYSA-N |
Product Overview
RefChem:262072 (CAS 33456-27-8), with molecular formula C28H34ClN3O and molecular weight 463.24 g/mol. IUPAC: 3-[1-[benzyl(ethyl)amino]-2-oxo-3-phenylindol-3-yl]propyl-dimethylazanium chloride.
Chemical Property Profile of RefChem:262072
Property Insights of RefChem:262072
The XLogP value of 0.69 suggests moderate lipophilicity, balancing water solubility and membrane permeability for RefChem:262072. With a topological polar surface area (TPSA) of 28.0 Ų, RefChem:262072 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, RefChem:262072 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 RefChem:262072?
The CAS number of RefChem:262072 is 33456-27-8.
What is the molecular formula of RefChem:262072?
The molecular formula of RefChem:262072 is C28H34ClN3O.
What is the molecular weight of RefChem:262072?
The molecular weight of RefChem:262072 is 463.24 g/mol.
Where can I buy RefChem:262072?
You can request a quote for RefChem:262072 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for RefChem:262072?
Yes, KEHONG BIO provides custom synthesis services for RefChem:262072 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.