2-[4-(2-phenylethenesulfonyl)piperazine-1-carbonyl]-4H-chromen-4-one
TL;DR: 2-[4-(2-phenylethenesulfonyl)piperazine-1-carbonyl]-4H-chromen-4-one (CAS 741732-54-7) is a chemical compound with molecular formula C22H20N2O5S and molecular weight 424.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[4-[(E)-2-phenylethenyl]sulfonylpiperazine-1-carbonyl]chromen-4-one
Also Known As: 2-[4-(2-phenylethenesulfonyl)piperazine-1-carbonyl]-4H-chromen-4-one, 2-[4-[(E)-2-phenylethenyl]sulfonylpiperazine-1-carbonyl]chromen-4-one
| Molecular Formula | C22H20N2O5S |
|---|---|
| Molecular Weight | 424.11 g/mol |
| LogP | 2.5515 |
| Topological Polar Surface Area | 87.9 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 424.10928 |
| Heavy Atoms | 30 |
| Complexity | 1257.4325 |
Chemical Identifiers
| CAS Number | 741732-54-7 |
|---|---|
| SMILES | C1CN(CCN1C(=O)C2=CC(=O)C3=CC=CC=C3O2)S(=O)(=O)/C=C/C4=CC=CC=C4 |
Product Overview
2-[4-(2-phenylethenesulfonyl)piperazine-1-carbonyl]-4H-chromen-4-one (CAS 741732-54-7), with molecular formula C22H20N2O5S and molecular weight 424.11 g/mol. IUPAC: 2-[4-[(E)-2-phenylethenyl]sulfonylpiperazine-1-carbonyl]chromen-4-one.
Chemical Property Profile of 2-[4-(2-phenylethenesulfonyl)piperazine-1-carbonyl]-4H-chromen-4-one
Property Insights of 2-[4-(2-phenylethenesulfonyl)piperazine-1-carbonyl]-4H-chromen-4-one
The XLogP value of 2.5515 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-[4-(2-phenylethenesulfonyl)piperazine-1-carbonyl]-4H-chromen-4-one. The TPSA of 87.9 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-[4-(2-phenylethenesulfonyl)piperazine-1-carbonyl]-4H-chromen-4-one. Following Lipinski's Rule of Five, 2-[4-(2-phenylethenesulfonyl)piperazine-1-carbonyl]-4H-chromen-4-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-[4-(2-phenylethenesulfonyl)piperazine-1-carbonyl]-4H-chromen-4-one?
The CAS number of 2-[4-(2-phenylethenesulfonyl)piperazine-1-carbonyl]-4H-chromen-4-one is 741732-54-7.
What is the molecular formula of 2-[4-(2-phenylethenesulfonyl)piperazine-1-carbonyl]-4H-chromen-4-one?
The molecular formula of 2-[4-(2-phenylethenesulfonyl)piperazine-1-carbonyl]-4H-chromen-4-one is C22H20N2O5S.
What is the molecular weight of 2-[4-(2-phenylethenesulfonyl)piperazine-1-carbonyl]-4H-chromen-4-one?
The molecular weight of 2-[4-(2-phenylethenesulfonyl)piperazine-1-carbonyl]-4H-chromen-4-one is 424.11 g/mol.
Where can I buy 2-[4-(2-phenylethenesulfonyl)piperazine-1-carbonyl]-4H-chromen-4-one?
You can request a quote for 2-[4-(2-phenylethenesulfonyl)piperazine-1-carbonyl]-4H-chromen-4-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-[4-(2-phenylethenesulfonyl)piperazine-1-carbonyl]-4H-chromen-4-one?
Yes, KEHONG BIO provides custom synthesis services for 2-[4-(2-phenylethenesulfonyl)piperazine-1-carbonyl]-4H-chromen-4-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.