5-(4-Benzhydryl-piperazine-1-carbonyl)-4,6-dimethyl-pyran-2-one
TL;DR: 5-(4-Benzhydryl-piperazine-1-carbonyl)-4,6-dimethyl-pyran-2-one (CAS 381174-35-2) is a chemical compound with molecular formula C25H26N2O3 and molecular weight 402.19 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-(4-benzhydrylpiperazine-1-carbonyl)-4,6-dimethylpyran-2-one
Also Known As: 5-(4-benzhydrylpiperazine-1-carbonyl)-4,6-dimethylpyran-2-one, 5-(4-Benzhydryl-piperazine-1-carbonyl)-4,6-dimethyl-pyran-2-one, 5-(4-benzhydrylpiperazine-1-carbonyl)-4,6-dimethyl-2H-pyran-2-one, 5-[(4-Benzhydryl-1-piperazinyl)carbonyl]-4,6-dimethyl-2H-pyran-2-one #, 5-{[4-(diphenylmethyl)piperazin-1-yl]carbonyl}-4,6-dimethyl-2H-pyran-2-one
| Molecular Formula | C25H26N2O3 |
|---|---|
| Molecular Weight | 402.19 g/mol |
| LogP | 3.3 |
| Topological Polar Surface Area | 49.9 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 402.19434 |
| Heavy Atoms | 30 |
| Complexity | 688.0 |
Chemical Identifiers
| CAS Number | 381174-35-2 |
|---|---|
| SMILES | CC1=CC(=O)OC(=C1C(=O)N2CCN(CC2)C(C3=CC=CC=C3)C4=CC=CC=C4)C |
| InChIKey | DXUNSUGICKLXQO-UHFFFAOYSA-N |
Product Overview
5-(4-Benzhydryl-piperazine-1-carbonyl)-4,6-dimethyl-pyran-2-one (CAS 381174-35-2), with molecular formula C25H26N2O3 and molecular weight 402.19 g/mol. IUPAC: 5-(4-benzhydrylpiperazine-1-carbonyl)-4,6-dimethylpyran-2-one.
Chemical Property Profile of 5-(4-Benzhydryl-piperazine-1-carbonyl)-4,6-dimethyl-pyran-2-one
Property Insights of 5-(4-Benzhydryl-piperazine-1-carbonyl)-4,6-dimethyl-pyran-2-one
The XLogP value of 3.3 indicates that 5-(4-Benzhydryl-piperazine-1-carbonyl)-4,6-dimethyl-pyran-2-one is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 49.9 Ų, 5-(4-Benzhydryl-piperazine-1-carbonyl)-4,6-dimethyl-pyran-2-one exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 5-(4-Benzhydryl-piperazine-1-carbonyl)-4,6-dimethyl-pyran-2-one has 0 hydrogen bond donor(s) and 4 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 5-(4-Benzhydryl-piperazine-1-carbonyl)-4,6-dimethyl-pyran-2-one?
The CAS number of 5-(4-Benzhydryl-piperazine-1-carbonyl)-4,6-dimethyl-pyran-2-one is 381174-35-2.
What is the molecular formula of 5-(4-Benzhydryl-piperazine-1-carbonyl)-4,6-dimethyl-pyran-2-one?
The molecular formula of 5-(4-Benzhydryl-piperazine-1-carbonyl)-4,6-dimethyl-pyran-2-one is C25H26N2O3.
What is the molecular weight of 5-(4-Benzhydryl-piperazine-1-carbonyl)-4,6-dimethyl-pyran-2-one?
The molecular weight of 5-(4-Benzhydryl-piperazine-1-carbonyl)-4,6-dimethyl-pyran-2-one is 402.19 g/mol.
Where can I buy 5-(4-Benzhydryl-piperazine-1-carbonyl)-4,6-dimethyl-pyran-2-one?
You can request a quote for 5-(4-Benzhydryl-piperazine-1-carbonyl)-4,6-dimethyl-pyran-2-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 5-(4-Benzhydryl-piperazine-1-carbonyl)-4,6-dimethyl-pyran-2-one?
Yes, KEHONG BIO provides custom synthesis services for 5-(4-Benzhydryl-piperazine-1-carbonyl)-4,6-dimethyl-pyran-2-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.