Ici 53165
TL;DR: Ici 53165 (CAS 37401-68-6) is a chemical compound with molecular formula C19H21NO2 and molecular weight 295.16 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-[3-(dimethylamino)propyl]-3-phenyl-2-benzofuran-1-one
Also Known As: Ici 53165, 3-gamma-Dimethylaminopropyl-3-phenylphthalide, ICI 53,165, ICI-53,165, 3-(gamma-Dimethylaminopropyl)-3-phenylphthalide
| Molecular Formula | C19H21NO2 |
|---|---|
| Molecular Weight | 295.16 g/mol |
| LogP | 3.3 |
| Topological Polar Surface Area | 29.5 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 5 |
| Exact Mass | 295.15723 |
| Heavy Atoms | 22 |
| Complexity | 389.0 |
Chemical Identifiers
| CAS Number | 37401-68-6 |
|---|---|
| SMILES | CN(C)CCCC1(C2=CC=CC=C2C(=O)O1)C3=CC=CC=C3 |
| InChIKey | BHDBEMWNWGBDBB-UHFFFAOYSA-N |
Product Overview
Ici 53165 (CAS 37401-68-6), with molecular formula C19H21NO2 and molecular weight 295.16 g/mol. IUPAC: 3-[3-(dimethylamino)propyl]-3-phenyl-2-benzofuran-1-one.
Chemical Property Profile of Ici 53165
Property Insights of Ici 53165
The XLogP value of 3.3 indicates that Ici 53165 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 29.5 Ų, Ici 53165 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Ici 53165 has 0 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 Ici 53165?
The CAS number of Ici 53165 is 37401-68-6.
What is the molecular formula of Ici 53165?
The molecular formula of Ici 53165 is C19H21NO2.
What is the molecular weight of Ici 53165?
The molecular weight of Ici 53165 is 295.16 g/mol.
Where can I buy Ici 53165?
You can request a quote for Ici 53165 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Ici 53165?
Yes, KEHONG BIO provides custom synthesis services for Ici 53165 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.