RefChem:72066
TL;DR: RefChem:72066 (CAS 33401-49-9) is a chemical compound with molecular formula C17H31ClN2O3Si and molecular weight 374.18 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N'-[(4-ethenylphenyl)methyl]-N-(3-trimethoxysilylpropyl)ethane-1,2-diamine;hydrochloride
Also Known As: 1,2-Ethanediamine, N-[(4-ethenylphenyl)methyl]-N'-[3-(trimethoxysilyl)propyl]-, monohydrochloride, N-(3-(Trimethoxysilyl)propyl)-N'-(4-vinylbenzyl)ethylenediamine monohydrochloride, 3-(n-styrylmethyl-2-aminoethylamino)propyltrimethoxysilane hydrochloride, I01-10319, 1,2-Ethanediamine, N-((4-ethenylphenyl)methyl)-N'-(3-(trimethoxysilyl)propyl)-, monohydrochloride
| Molecular Formula | C17H31ClN2O3Si |
|---|---|
| Molecular Weight | 374.18 g/mol |
| LogP | 2.7 |
| Topological Polar Surface Area | 51.8 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 13 |
| Exact Mass | 374.17926 |
| Heavy Atoms | 24 |
| Complexity | 298.0 |
Chemical Identifiers
| CAS Number | 33401-49-9 |
|---|---|
| SMILES | CO[Si](CCCNCCNCC1=CC=C(C=C1)C=C)(OC)OC.Cl |
| InChIKey | JWIKADZFCMEWBV-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 7 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
RefChem:72066 (CAS 33401-49-9), with molecular formula C17H31ClN2O3Si and molecular weight 374.18 g/mol. IUPAC: N'-[(4-ethenylphenyl)methyl]-N-(3-trimethoxysilylpropyl)ethane-1,2-diamine;hydrochloride.
Chemical Property Profile of RefChem:72066
Property Insights of RefChem:72066
The XLogP value of 2.7 suggests moderate lipophilicity, balancing water solubility and membrane permeability for RefChem:72066. With a topological polar surface area (TPSA) of 51.8 Ų, RefChem:72066 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, RefChem:72066 has 3 hydrogen bond donor(s) and 5 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:72066?
The CAS number of RefChem:72066 is 33401-49-9.
What is the molecular formula of RefChem:72066?
The molecular formula of RefChem:72066 is C17H31ClN2O3Si.
What is the molecular weight of RefChem:72066?
The molecular weight of RefChem:72066 is 374.18 g/mol.
Where can I buy RefChem:72066?
You can request a quote for RefChem:72066 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for RefChem:72066?
Yes, KEHONG BIO provides custom synthesis services for RefChem:72066 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.