N-(2-Hydroxyethyl)-N-propargyl-2,4-dichlorobenzylamine
TL;DR: N-(2-Hydroxyethyl)-N-propargyl-2,4-dichlorobenzylamine (CAS 1211-52-5) is a chemical compound with molecular formula C12H13Cl2NO and molecular weight 257.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[(2,4-dichlorophenyl)methyl-prop-2-ynylamino]ethanol
Also Known As: N-(2-Hydroxyethyl)-N-propargyl-2,4-dichlorobenzylamine, 2-(((2,4-Dichlorophenyl)methyl)-2-propynylamino)ethanol, Ethanol, 2-(((2,4-dichlorophenyl)methyl)-2-propyn-1-ylamino)-, 2-[(2,4-dichlorophenyl)methyl-prop-2-ynylamino]ethanol, N-(2-HYDROXYETHYL)-N-PROPARGYL-2,4-DICHLOROBENZYLAMINE HYDROCHLORIDE
| Molecular Formula | C12H13Cl2NO |
|---|---|
| Molecular Weight | 257.04 g/mol |
| LogP | 2.4 |
| Topological Polar Surface Area | 23.5 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 5 |
| Exact Mass | 257.0374 |
| Heavy Atoms | 16 |
| Complexity | 251.0 |
Chemical Identifiers
| CAS Number | 1211-52-5 |
|---|---|
| SMILES | C#CCN(CCO)CC1=C(C=C(C=C1)Cl)Cl |
| InChIKey | XYHDZHVOIVOSLJ-UHFFFAOYSA-N |
Product Overview
N-(2-Hydroxyethyl)-N-propargyl-2,4-dichlorobenzylamine (CAS 1211-52-5), with molecular formula C12H13Cl2NO and molecular weight 257.04 g/mol. IUPAC: 2-[(2,4-dichlorophenyl)methyl-prop-2-ynylamino]ethanol.
Chemical Property Profile of N-(2-Hydroxyethyl)-N-propargyl-2,4-dichlorobenzylamine
Property Insights of N-(2-Hydroxyethyl)-N-propargyl-2,4-dichlorobenzylamine
The XLogP value of 2.4 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-(2-Hydroxyethyl)-N-propargyl-2,4-dichlorobenzylamine. With a topological polar surface area (TPSA) of 23.5 Ų, N-(2-Hydroxyethyl)-N-propargyl-2,4-dichlorobenzylamine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N-(2-Hydroxyethyl)-N-propargyl-2,4-dichlorobenzylamine has 1 hydrogen bond donor(s) and 2 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-Hydroxyethyl)-N-propargyl-2,4-dichlorobenzylamine?
The CAS number of N-(2-Hydroxyethyl)-N-propargyl-2,4-dichlorobenzylamine is 1211-52-5.
What is the molecular formula of N-(2-Hydroxyethyl)-N-propargyl-2,4-dichlorobenzylamine?
The molecular formula of N-(2-Hydroxyethyl)-N-propargyl-2,4-dichlorobenzylamine is C12H13Cl2NO.
What is the molecular weight of N-(2-Hydroxyethyl)-N-propargyl-2,4-dichlorobenzylamine?
The molecular weight of N-(2-Hydroxyethyl)-N-propargyl-2,4-dichlorobenzylamine is 257.04 g/mol.
Where can I buy N-(2-Hydroxyethyl)-N-propargyl-2,4-dichlorobenzylamine?
You can request a quote for N-(2-Hydroxyethyl)-N-propargyl-2,4-dichlorobenzylamine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-(2-Hydroxyethyl)-N-propargyl-2,4-dichlorobenzylamine?
Yes, KEHONG BIO provides custom synthesis services for N-(2-Hydroxyethyl)-N-propargyl-2,4-dichlorobenzylamine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.