N-(2,4-Dichlorophenoxyacetyl)-beta-aminoethylhomomorpholine
TL;DR: N-(2,4-Dichlorophenoxyacetyl)-beta-aminoethylhomomorpholine (CAS 49809-05-4) is a chemical compound with molecular formula C15H20Cl2N2O3 and molecular weight 346.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(2,4-dichlorophenoxy)-N-[2-(1,4-oxazepan-4-yl)ethyl]acetamide
Also Known As: N-(2,4-Dichlorophenoxyacetyl)-beta-aminoethylhomomorpholine, Acetamide, 2-(2,4-dichlorophenoxy)-N-(2-(tetrahydro-1,4-oxazepin-4(5H)-yl)ethyl)-, N-(2,4-Dwuchlorofenoksyacetylo)-beta-aminoetylohomomorfoliny, N-(2,4-Dwuchlorofenoksyacetylo)-beta-aminoetylohomomorfoliny [Polish], 2-(2,4-Dichlorophenoxy)-N-(2-(tetrahydro-1,4-oxazepin-4(5H)-yl)ethyl)acetamide
| Molecular Formula | C15H20Cl2N2O3 |
|---|---|
| Molecular Weight | 346.09 g/mol |
| LogP | 2.5 |
| Topological Polar Surface Area | 50.8 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 6 |
| Exact Mass | 346.08508 |
| Heavy Atoms | 22 |
| Complexity | 347.0 |
Chemical Identifiers
| CAS Number | 49809-05-4 |
|---|---|
| SMILES | C1CN(CCOC1)CCNC(=O)COC2=C(C=C(C=C2)Cl)Cl |
| InChIKey | BBZWEXAAGLXJQC-UHFFFAOYSA-N |
Product Overview
N-(2,4-Dichlorophenoxyacetyl)-beta-aminoethylhomomorpholine (CAS 49809-05-4), with molecular formula C15H20Cl2N2O3 and molecular weight 346.09 g/mol. IUPAC: 2-(2,4-dichlorophenoxy)-N-[2-(1,4-oxazepan-4-yl)ethyl]acetamide.
Chemical Property Profile of N-(2,4-Dichlorophenoxyacetyl)-beta-aminoethylhomomorpholine
Property Insights of N-(2,4-Dichlorophenoxyacetyl)-beta-aminoethylhomomorpholine
The XLogP value of 2.5 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-(2,4-Dichlorophenoxyacetyl)-beta-aminoethylhomomorpholine. With a topological polar surface area (TPSA) of 50.8 Ų, N-(2,4-Dichlorophenoxyacetyl)-beta-aminoethylhomomorpholine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N-(2,4-Dichlorophenoxyacetyl)-beta-aminoethylhomomorpholine has 1 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 N-(2,4-Dichlorophenoxyacetyl)-beta-aminoethylhomomorpholine?
The CAS number of N-(2,4-Dichlorophenoxyacetyl)-beta-aminoethylhomomorpholine is 49809-05-4.
What is the molecular formula of N-(2,4-Dichlorophenoxyacetyl)-beta-aminoethylhomomorpholine?
The molecular formula of N-(2,4-Dichlorophenoxyacetyl)-beta-aminoethylhomomorpholine is C15H20Cl2N2O3.
What is the molecular weight of N-(2,4-Dichlorophenoxyacetyl)-beta-aminoethylhomomorpholine?
The molecular weight of N-(2,4-Dichlorophenoxyacetyl)-beta-aminoethylhomomorpholine is 346.09 g/mol.
Where can I buy N-(2,4-Dichlorophenoxyacetyl)-beta-aminoethylhomomorpholine?
You can request a quote for N-(2,4-Dichlorophenoxyacetyl)-beta-aminoethylhomomorpholine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-(2,4-Dichlorophenoxyacetyl)-beta-aminoethylhomomorpholine?
Yes, KEHONG BIO provides custom synthesis services for N-(2,4-Dichlorophenoxyacetyl)-beta-aminoethylhomomorpholine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.