2-[3-(4-tert-butylphenoxy)propyl]-7,8-dimethoxyphthalazin-1(2H)-one
TL;DR: 2-[3-(4-tert-butylphenoxy)propyl]-7,8-dimethoxyphthalazin-1(2H)-one (CAS 797795-03-0) is a chemical compound with molecular formula C23H28N2O4 and molecular weight 396.20 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[3-(4-tert-butylphenoxy)propyl]-7,8-dimethoxyphthalazin-1-one
Also Known As: 2-[3-(4-tert-butylphenoxy)propyl]-7,8-dimethoxyphthalazin-1-one, 2-(3-(4-(tert-butyl)phenoxy)propyl)-7,8-dimethoxyphthalazin-1(2H)-one, 2-[3-(4-tert-butylphenoxy)propyl]-7,8-dimethoxyphthalazin-1(2H)-one
| Molecular Formula | C23H28N2O4 |
|---|---|
| Molecular Weight | 396.20 g/mol |
| LogP | 4.1803 |
| Topological Polar Surface Area | 62.58 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 7 |
| Exact Mass | 396.2049 |
| Heavy Atoms | 29 |
| Complexity | 1033.6577 |
Chemical Identifiers
| CAS Number | 797795-03-0 |
|---|---|
| SMILES | CC(C)(C)C1=CC=C(C=C1)OCCCN2C(=O)C3=C(C=CC(=C3OC)OC)C=N2 |
Product Overview
2-[3-(4-tert-butylphenoxy)propyl]-7,8-dimethoxyphthalazin-1(2H)-one (CAS 797795-03-0), with molecular formula C23H28N2O4 and molecular weight 396.20 g/mol. IUPAC: 2-[3-(4-tert-butylphenoxy)propyl]-7,8-dimethoxyphthalazin-1-one.
Chemical Property Profile of 2-[3-(4-tert-butylphenoxy)propyl]-7,8-dimethoxyphthalazin-1(2H)-one
Property Insights of 2-[3-(4-tert-butylphenoxy)propyl]-7,8-dimethoxyphthalazin-1(2H)-one
The XLogP value of 4.1803 indicates that 2-[3-(4-tert-butylphenoxy)propyl]-7,8-dimethoxyphthalazin-1(2H)-one is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 62.58 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-[3-(4-tert-butylphenoxy)propyl]-7,8-dimethoxyphthalazin-1(2H)-one. Following Lipinski's Rule of Five, 2-[3-(4-tert-butylphenoxy)propyl]-7,8-dimethoxyphthalazin-1(2H)-one has 0 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 2-[3-(4-tert-butylphenoxy)propyl]-7,8-dimethoxyphthalazin-1(2H)-one?
The CAS number of 2-[3-(4-tert-butylphenoxy)propyl]-7,8-dimethoxyphthalazin-1(2H)-one is 797795-03-0.
What is the molecular formula of 2-[3-(4-tert-butylphenoxy)propyl]-7,8-dimethoxyphthalazin-1(2H)-one?
The molecular formula of 2-[3-(4-tert-butylphenoxy)propyl]-7,8-dimethoxyphthalazin-1(2H)-one is C23H28N2O4.
What is the molecular weight of 2-[3-(4-tert-butylphenoxy)propyl]-7,8-dimethoxyphthalazin-1(2H)-one?
The molecular weight of 2-[3-(4-tert-butylphenoxy)propyl]-7,8-dimethoxyphthalazin-1(2H)-one is 396.20 g/mol.
Where can I buy 2-[3-(4-tert-butylphenoxy)propyl]-7,8-dimethoxyphthalazin-1(2H)-one?
You can request a quote for 2-[3-(4-tert-butylphenoxy)propyl]-7,8-dimethoxyphthalazin-1(2H)-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-[3-(4-tert-butylphenoxy)propyl]-7,8-dimethoxyphthalazin-1(2H)-one?
Yes, KEHONG BIO provides custom synthesis services for 2-[3-(4-tert-butylphenoxy)propyl]-7,8-dimethoxyphthalazin-1(2H)-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.