![4-(4-methylphenyl)-2-[3-oxo-3-(pyrrolidin-1-yl)propyl]phthalazin-1(2H)-one structure](/static/products/694/694476-37-4.png)
4-(4-methylphenyl)-2-[3-oxo-3-(pyrrolidin-1-yl)propyl]phthalazin-1(2H)-one
TL;DR: 4-(4-methylphenyl)-2-[3-oxo-3-(pyrrolidin-1-yl)propyl]phthalazin-1(2H)-one (CAS 694476-37-4) is a chemical compound with molecular formula C22H23N3O2 and molecular weight 361.18 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-(4-methylphenyl)-2-(3-oxo-3-pyrrolidin-1-ylpropyl)phthalazin-1-one
Also Known As: ChemDiv3_005537, IDI1_023447, BRD-K55731022-001-01-1, 2-(3-oxo-3-(pyrrolidin-1-yl)propyl)-4-(p-tolyl)phthalazin-1(2H)-one, 4-(4-methylphenyl)-2-(3-oxo-3-pyrrolidin-1-ylpropyl)phthalazin-1-one
| Molecular Formula | C22H23N3O2 |
|---|---|
| Molecular Weight | 361.18 g/mol |
| LogP | 3.38442 |
| Topological Polar Surface Area | 55.2 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 361.17902 |
| Heavy Atoms | 27 |
| Complexity | 1031.6024 |
Chemical Identifiers
| CAS Number | 694476-37-4 |
|---|---|
| SMILES | CC1=CC=C(C=C1)C2=NN(C(=O)C3=CC=CC=C32)CCC(=O)N4CCCC4 |
Product Overview
4-(4-methylphenyl)-2-[3-oxo-3-(pyrrolidin-1-yl)propyl]phthalazin-1(2H)-one (CAS 694476-37-4), with molecular formula C22H23N3O2 and molecular weight 361.18 g/mol. IUPAC: 4-(4-methylphenyl)-2-(3-oxo-3-pyrrolidin-1-ylpropyl)phthalazin-1-one.
Chemical Property Profile of 4-(4-methylphenyl)-2-[3-oxo-3-(pyrrolidin-1-yl)propyl]phthalazin-1(2H)-one
Property Insights of 4-(4-methylphenyl)-2-[3-oxo-3-(pyrrolidin-1-yl)propyl]phthalazin-1(2H)-one
The XLogP value of 3.38442 indicates that 4-(4-methylphenyl)-2-[3-oxo-3-(pyrrolidin-1-yl)propyl]phthalazin-1(2H)-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, 4-(4-methylphenyl)-2-[3-oxo-3-(pyrrolidin-1-yl)propyl]phthalazin-1(2H)-one exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4-(4-methylphenyl)-2-[3-oxo-3-(pyrrolidin-1-yl)propyl]phthalazin-1(2H)-one has 0 hydrogen bond donor(s) and 3 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 4-(4-methylphenyl)-2-[3-oxo-3-(pyrrolidin-1-yl)propyl]phthalazin-1(2H)-one?
The CAS number of 4-(4-methylphenyl)-2-[3-oxo-3-(pyrrolidin-1-yl)propyl]phthalazin-1(2H)-one is 694476-37-4.
What is the molecular formula of 4-(4-methylphenyl)-2-[3-oxo-3-(pyrrolidin-1-yl)propyl]phthalazin-1(2H)-one?
The molecular formula of 4-(4-methylphenyl)-2-[3-oxo-3-(pyrrolidin-1-yl)propyl]phthalazin-1(2H)-one is C22H23N3O2.
What is the molecular weight of 4-(4-methylphenyl)-2-[3-oxo-3-(pyrrolidin-1-yl)propyl]phthalazin-1(2H)-one?
The molecular weight of 4-(4-methylphenyl)-2-[3-oxo-3-(pyrrolidin-1-yl)propyl]phthalazin-1(2H)-one is 361.18 g/mol.
Where can I buy 4-(4-methylphenyl)-2-[3-oxo-3-(pyrrolidin-1-yl)propyl]phthalazin-1(2H)-one?
You can request a quote for 4-(4-methylphenyl)-2-[3-oxo-3-(pyrrolidin-1-yl)propyl]phthalazin-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 4-(4-methylphenyl)-2-[3-oxo-3-(pyrrolidin-1-yl)propyl]phthalazin-1(2H)-one?
Yes, KEHONG BIO provides custom synthesis services for 4-(4-methylphenyl)-2-[3-oxo-3-(pyrrolidin-1-yl)propyl]phthalazin-1(2H)-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.