![2-butyl-4-[4-(2-phenylethenesulfonyl)piperazine-1-carbonyl]-1,2-dihydrophthalazin-1-one structure](/static/products/875/875302-38-8.png)
2-butyl-4-[4-(2-phenylethenesulfonyl)piperazine-1-carbonyl]-1,2-dihydrophthalazin-1-one
TL;DR: 2-butyl-4-[4-(2-phenylethenesulfonyl)piperazine-1-carbonyl]-1,2-dihydrophthalazin-1-one (CAS 875302-38-8) is a chemical compound with molecular formula C25H28N4O4S and molecular weight 480.18 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-butyl-4-[4-[(E)-2-phenylethenyl]sulfonylpiperazine-1-carbonyl]phthalazin-1-one
Also Known As: 2-butyl-4-[4-(2-phenylethenesulfonyl)piperazine-1-carbonyl]-1,2-dihydrophthalazin-1-one, 2-butyl-4-[4-[(E)-2-phenylethenyl]sulfonylpiperazine-1-carbonyl]phthalazin-1-one
| Molecular Formula | C25H28N4O4S |
|---|---|
| Molecular Weight | 480.18 g/mol |
| LogP | 2.9551 |
| Topological Polar Surface Area | 92.58 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 7 |
| Exact Mass | 480.18314 |
| Heavy Atoms | 34 |
| Complexity | 1358.6761 |
Chemical Identifiers
| CAS Number | 875302-38-8 |
|---|---|
| SMILES | CCCCN1C(=O)C2=CC=CC=C2C(=N1)C(=O)N3CCN(CC3)S(=O)(=O)/C=C/C4=CC=CC=C4 |
Product Overview
2-butyl-4-[4-(2-phenylethenesulfonyl)piperazine-1-carbonyl]-1,2-dihydrophthalazin-1-one (CAS 875302-38-8), with molecular formula C25H28N4O4S and molecular weight 480.18 g/mol. IUPAC: 2-butyl-4-[4-[(E)-2-phenylethenyl]sulfonylpiperazine-1-carbonyl]phthalazin-1-one.
Chemical Property Profile of 2-butyl-4-[4-(2-phenylethenesulfonyl)piperazine-1-carbonyl]-1,2-dihydrophthalazin-1-one
Property Insights of 2-butyl-4-[4-(2-phenylethenesulfonyl)piperazine-1-carbonyl]-1,2-dihydrophthalazin-1-one
The XLogP value of 2.9551 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-butyl-4-[4-(2-phenylethenesulfonyl)piperazine-1-carbonyl]-1,2-dihydrophthalazin-1-one. The TPSA of 92.58 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-butyl-4-[4-(2-phenylethenesulfonyl)piperazine-1-carbonyl]-1,2-dihydrophthalazin-1-one. Following Lipinski's Rule of Five, 2-butyl-4-[4-(2-phenylethenesulfonyl)piperazine-1-carbonyl]-1,2-dihydrophthalazin-1-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-butyl-4-[4-(2-phenylethenesulfonyl)piperazine-1-carbonyl]-1,2-dihydrophthalazin-1-one?
The CAS number of 2-butyl-4-[4-(2-phenylethenesulfonyl)piperazine-1-carbonyl]-1,2-dihydrophthalazin-1-one is 875302-38-8.
What is the molecular formula of 2-butyl-4-[4-(2-phenylethenesulfonyl)piperazine-1-carbonyl]-1,2-dihydrophthalazin-1-one?
The molecular formula of 2-butyl-4-[4-(2-phenylethenesulfonyl)piperazine-1-carbonyl]-1,2-dihydrophthalazin-1-one is C25H28N4O4S.
What is the molecular weight of 2-butyl-4-[4-(2-phenylethenesulfonyl)piperazine-1-carbonyl]-1,2-dihydrophthalazin-1-one?
The molecular weight of 2-butyl-4-[4-(2-phenylethenesulfonyl)piperazine-1-carbonyl]-1,2-dihydrophthalazin-1-one is 480.18 g/mol.
Where can I buy 2-butyl-4-[4-(2-phenylethenesulfonyl)piperazine-1-carbonyl]-1,2-dihydrophthalazin-1-one?
You can request a quote for 2-butyl-4-[4-(2-phenylethenesulfonyl)piperazine-1-carbonyl]-1,2-dihydrophthalazin-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-butyl-4-[4-(2-phenylethenesulfonyl)piperazine-1-carbonyl]-1,2-dihydrophthalazin-1-one?
Yes, KEHONG BIO provides custom synthesis services for 2-butyl-4-[4-(2-phenylethenesulfonyl)piperazine-1-carbonyl]-1,2-dihydrophthalazin-1-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.