RefChem:314711
TL;DR: RefChem:314711 (CAS 96394-97-7) is a chemical compound with molecular formula C15H22ClNO3 and molecular weight 299.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-chloro-N-[2-ethyl-6-(hydroxymethyl)phenyl]-N-(1-methoxypropan-2-yl)acetamide
Also Known As: 2-chloro-N-[2-ethyl-6-(hydroxymethyl)phenyl]-N-(1-methoxypropan-2-yl)acetamide, Acetamide, 2-chloro-N-(2-ethyl-6-(hydroxymethyl)phenyl)-N-(2-methoxy-1-methylethyl)-, 2-chloro-N-(2-ethyl-6-hydroxymethylphenyl)-N-(2-methoxy-1-methylethyl)acetamide, 2-Chloro-N-[2-ethyl-6-(hydroxymethyl)phenyl]-N-(2-methoxy-1-methylethyl)acetamide, RefChem:314711
| Molecular Formula | C15H22ClNO3 |
|---|---|
| Molecular Weight | 299.13 g/mol |
| LogP | 1.9 |
| Topological Polar Surface Area | 49.8 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 7 |
| Exact Mass | 299.1288 |
| Heavy Atoms | 20 |
| Complexity | 301.0 |
Chemical Identifiers
| CAS Number | 96394-97-7 |
|---|---|
| SMILES | CCC1=C(C(=CC=C1)CO)N(C(C)COC)C(=O)CCl |
| InChIKey | NSSANYABZCITBA-UHFFFAOYSA-N |
Product Overview
RefChem:314711 (CAS 96394-97-7), with molecular formula C15H22ClNO3 and molecular weight 299.13 g/mol. IUPAC: 2-chloro-N-[2-ethyl-6-(hydroxymethyl)phenyl]-N-(1-methoxypropan-2-yl)acetamide.
Chemical Property Profile of RefChem:314711
Property Insights of RefChem:314711
The XLogP value of 1.9 suggests moderate lipophilicity, balancing water solubility and membrane permeability for RefChem:314711. With a topological polar surface area (TPSA) of 49.8 Ų, RefChem:314711 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, RefChem:314711 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:314711?
The CAS number of RefChem:314711 is 96394-97-7.
What is the molecular formula of RefChem:314711?
The molecular formula of RefChem:314711 is C15H22ClNO3.
What is the molecular weight of RefChem:314711?
The molecular weight of RefChem:314711 is 299.13 g/mol.
Where can I buy RefChem:314711?
You can request a quote for RefChem:314711 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for RefChem:314711?
Yes, KEHONG BIO provides custom synthesis services for RefChem:314711 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.