![2-[3-(4-Benzylpiperidin-1-yl)-3-oxopropyl]-4-(4-methylphenyl)phthalazin-1-one structure](/static/products/6944/694466-72-3.webp)
2-[3-(4-Benzylpiperidin-1-yl)-3-oxopropyl]-4-(4-methylphenyl)phthalazin-1-one
TL;DR: 2-[3-(4-Benzylpiperidin-1-yl)-3-oxopropyl]-4-(4-methylphenyl)phthalazin-1-one (CAS 694466-72-3) is a chemical compound with molecular formula C30H31N3O2 and molecular weight 465.24 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[3-(4-benzylpiperidin-1-yl)-3-oxopropyl]-4-(4-methylphenyl)phthalazin-1-one
Also Known As: 2-[3-(4-benzylpiperidin-1-yl)-3-oxopropyl]-4-(4-methylphenyl)phthalazin-1-one, 2-(3-(4-benzylpiperidin-1-yl)-3-oxopropyl)-4-(p-tolyl)phthalazin-1(2H)-one, 2-[3-(4-benzyl-1-piperidyl)-3-oxo-propyl]-4-(4-methylphenyl)phthalazin-1-one, 2-[3-(4-benzylpiperidin-1-yl)-3-oxopropyl]-4-(4-methylphenyl)phthalazin-1(2H)-one
| Molecular Formula | C30H31N3O2 |
|---|---|
| Molecular Weight | 465.24 g/mol |
| LogP | 5.24332 |
| Topological Polar Surface Area | 55.2 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 6 |
| Exact Mass | 465.24164 |
| Heavy Atoms | 35 |
| Complexity | 1368.6484 |
Chemical Identifiers
| CAS Number | 694466-72-3 |
|---|---|
| SMILES | CC1=CC=C(C=C1)C2=NN(C(=O)C3=CC=CC=C32)CCC(=O)N4CCC(CC4)CC5=CC=CC=C5 |
Product Overview
2-[3-(4-Benzylpiperidin-1-yl)-3-oxopropyl]-4-(4-methylphenyl)phthalazin-1-one (CAS 694466-72-3), with molecular formula C30H31N3O2 and molecular weight 465.24 g/mol. IUPAC: 2-[3-(4-benzylpiperidin-1-yl)-3-oxopropyl]-4-(4-methylphenyl)phthalazin-1-one.
Chemical Property Profile of 2-[3-(4-Benzylpiperidin-1-yl)-3-oxopropyl]-4-(4-methylphenyl)phthalazin-1-one
Property Insights of 2-[3-(4-Benzylpiperidin-1-yl)-3-oxopropyl]-4-(4-methylphenyl)phthalazin-1-one
The XLogP value of 5.24332 indicates that 2-[3-(4-Benzylpiperidin-1-yl)-3-oxopropyl]-4-(4-methylphenyl)phthalazin-1-one is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 55.2 Ų, 2-[3-(4-Benzylpiperidin-1-yl)-3-oxopropyl]-4-(4-methylphenyl)phthalazin-1-one exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-[3-(4-Benzylpiperidin-1-yl)-3-oxopropyl]-4-(4-methylphenyl)phthalazin-1-one has 0 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 2-[3-(4-Benzylpiperidin-1-yl)-3-oxopropyl]-4-(4-methylphenyl)phthalazin-1-one?
The CAS number of 2-[3-(4-Benzylpiperidin-1-yl)-3-oxopropyl]-4-(4-methylphenyl)phthalazin-1-one is 694466-72-3.
What is the molecular formula of 2-[3-(4-Benzylpiperidin-1-yl)-3-oxopropyl]-4-(4-methylphenyl)phthalazin-1-one?
The molecular formula of 2-[3-(4-Benzylpiperidin-1-yl)-3-oxopropyl]-4-(4-methylphenyl)phthalazin-1-one is C30H31N3O2.
What is the molecular weight of 2-[3-(4-Benzylpiperidin-1-yl)-3-oxopropyl]-4-(4-methylphenyl)phthalazin-1-one?
The molecular weight of 2-[3-(4-Benzylpiperidin-1-yl)-3-oxopropyl]-4-(4-methylphenyl)phthalazin-1-one is 465.24 g/mol.
Where can I buy 2-[3-(4-Benzylpiperidin-1-yl)-3-oxopropyl]-4-(4-methylphenyl)phthalazin-1-one?
You can request a quote for 2-[3-(4-Benzylpiperidin-1-yl)-3-oxopropyl]-4-(4-methylphenyl)phthalazin-1-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-Benzylpiperidin-1-yl)-3-oxopropyl]-4-(4-methylphenyl)phthalazin-1-one?
Yes, KEHONG BIO provides custom synthesis services for 2-[3-(4-Benzylpiperidin-1-yl)-3-oxopropyl]-4-(4-methylphenyl)phthalazin-1-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.