RefChem:265604
TL;DR: RefChem:265604 (CAS 28396-68-1) is a chemical compound with molecular formula C16H24ClNO3 and molecular weight 313.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-[(2,3-dimethyl-1-benzofuran-4-yl)oxy]-3-(propan-2-ylamino)propan-2-ol;hydrochloride
Also Known As: 1- oxy-3- propan-2-olhydrochloride, 1-((2,3-Dimethyl-4-benzofuranyl)oxy)-3-(isopropylamino)-2-propanol hydrochloride, (Dimethyl-2,3 benzofuryloxy-4)-1 hydroxy-2 isopropylamino-3 propane [French], (Dimethyl-2,3 benzofuryloxy-4)-1 hydroxy-2 isopropylamino-3 propane, 2-Propanol, 1-((2,3-dimethyl-4-benzofuranyl)oxy)-3-(isopropylamino)-, hydrochloride
| Molecular Formula | C16H24ClNO3 |
|---|---|
| Molecular Weight | 313.14 g/mol |
| LogP | 3.20914 |
| Topological Polar Surface Area | 54.6 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 6 |
| Exact Mass | 313.14447 |
| Heavy Atoms | 21 |
| Complexity | 297.0 |
Chemical Identifiers
| CAS Number | 28396-68-1 |
|---|---|
| SMILES | CC1=C(OC2=C1C(=CC=C2)OCC(CNC(C)C)O)C.Cl |
| InChIKey | ATGXFAUSUZPOIH-UHFFFAOYSA-N |
Product Overview
RefChem:265604 (CAS 28396-68-1), with molecular formula C16H24ClNO3 and molecular weight 313.14 g/mol. IUPAC: 1-[(2,3-dimethyl-1-benzofuran-4-yl)oxy]-3-(propan-2-ylamino)propan-2-ol;hydrochloride.
Chemical Property Profile of RefChem:265604
Property Insights of RefChem:265604
The XLogP value of 3.20914 indicates that RefChem:265604 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 54.6 Ų, RefChem:265604 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, RefChem:265604 has 3 hydrogen bond donor(s) and 4 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:265604?
The CAS number of RefChem:265604 is 28396-68-1.
What is the molecular formula of RefChem:265604?
The molecular formula of RefChem:265604 is C16H24ClNO3.
What is the molecular weight of RefChem:265604?
The molecular weight of RefChem:265604 is 313.14 g/mol.
Where can I buy RefChem:265604?
You can request a quote for RefChem:265604 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for RefChem:265604?
Yes, KEHONG BIO provides custom synthesis services for RefChem:265604 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.