2-(alpha-((Benzylamino)methyl)benzyl)-6-isopropoxy-3(2H)-pyridazinone hydrochloride
TL;DR: 2-(alpha-((Benzylamino)methyl)benzyl)-6-isopropoxy-3(2H)-pyridazinone hydrochloride (CAS 17072-79-6) is a chemical compound with molecular formula C22H26ClN3O2 and molecular weight 399.17 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[2-(benzylamino)-1-phenylethyl]-6-propan-2-yloxypyridazin-3-one;hydrochloride
Also Known As: 2-(alpha-((Benzylamino)methyl)benzyl)-6-isopropoxy-3(2H)-pyridazinone hydrochloride, 3(2H)-Pyridazinone, 2-(alpha-((benzylamino)methyl)benzyl)-6-isopropoxy-, monohydrochloride, 2-[2-(benzylamino)-1-phenylethyl]-6-propan-2-yloxypyridazin-3-one hydrochloride, 2-[2-(Benzylamino)-1-phenylethyl]-6-[(propan-2-yl)oxy]pyridazin-3(2H)-one--hydrogen chloride (1/1), RefChem:269499
| Molecular Formula | C22H26ClN3O2 |
|---|---|
| Molecular Weight | 399.17 g/mol |
| LogP | 3.8315 |
| Topological Polar Surface Area | 53.9 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 8 |
| Exact Mass | 399.17136 |
| Heavy Atoms | 28 |
| Complexity | 532.0 |
Chemical Identifiers
| CAS Number | 17072-79-6 |
|---|---|
| SMILES | CC(C)OC1=NN(C(=O)C=C1)C(CNCC2=CC=CC=C2)C3=CC=CC=C3.Cl |
| InChIKey | OTSXKCDQIDDMPW-UHFFFAOYSA-N |
Product Overview
2-(alpha-((Benzylamino)methyl)benzyl)-6-isopropoxy-3(2H)-pyridazinone hydrochloride (CAS 17072-79-6), with molecular formula C22H26ClN3O2 and molecular weight 399.17 g/mol. IUPAC: 2-[2-(benzylamino)-1-phenylethyl]-6-propan-2-yloxypyridazin-3-one;hydrochloride.
Chemical Property Profile of 2-(alpha-((Benzylamino)methyl)benzyl)-6-isopropoxy-3(2H)-pyridazinone hydrochloride
Property Insights of 2-(alpha-((Benzylamino)methyl)benzyl)-6-isopropoxy-3(2H)-pyridazinone hydrochloride
The XLogP value of 3.8315 indicates that 2-(alpha-((Benzylamino)methyl)benzyl)-6-isopropoxy-3(2H)-pyridazinone hydrochloride is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 53.9 Ų, 2-(alpha-((Benzylamino)methyl)benzyl)-6-isopropoxy-3(2H)-pyridazinone hydrochloride exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-(alpha-((Benzylamino)methyl)benzyl)-6-isopropoxy-3(2H)-pyridazinone hydrochloride has 2 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 2-(alpha-((Benzylamino)methyl)benzyl)-6-isopropoxy-3(2H)-pyridazinone hydrochloride?
The CAS number of 2-(alpha-((Benzylamino)methyl)benzyl)-6-isopropoxy-3(2H)-pyridazinone hydrochloride is 17072-79-6.
What is the molecular formula of 2-(alpha-((Benzylamino)methyl)benzyl)-6-isopropoxy-3(2H)-pyridazinone hydrochloride?
The molecular formula of 2-(alpha-((Benzylamino)methyl)benzyl)-6-isopropoxy-3(2H)-pyridazinone hydrochloride is C22H26ClN3O2.
What is the molecular weight of 2-(alpha-((Benzylamino)methyl)benzyl)-6-isopropoxy-3(2H)-pyridazinone hydrochloride?
The molecular weight of 2-(alpha-((Benzylamino)methyl)benzyl)-6-isopropoxy-3(2H)-pyridazinone hydrochloride is 399.17 g/mol.
Where can I buy 2-(alpha-((Benzylamino)methyl)benzyl)-6-isopropoxy-3(2H)-pyridazinone hydrochloride?
You can request a quote for 2-(alpha-((Benzylamino)methyl)benzyl)-6-isopropoxy-3(2H)-pyridazinone hydrochloride directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-(alpha-((Benzylamino)methyl)benzyl)-6-isopropoxy-3(2H)-pyridazinone hydrochloride?
Yes, KEHONG BIO provides custom synthesis services for 2-(alpha-((Benzylamino)methyl)benzyl)-6-isopropoxy-3(2H)-pyridazinone hydrochloride and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.