4-((1-(3-Phenylpropyl)-4-piperidyl)amino)-2-benzopyrone
TL;DR: 4-((1-(3-Phenylpropyl)-4-piperidyl)amino)-2-benzopyrone (CAS 54729-42-9) is a chemical compound with molecular formula C23H26N2O2 and molecular weight 362.20 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-[[1-(3-phenylpropyl)piperidin-4-yl]amino]chromen-2-one
Also Known As: EINECS 259-308-0, 4-((1-(3-Phenylpropyl)-4-piperidyl)amino)-2-benzopyrone, 4-[[1-(3-phenylpropyl)-4-piperidyl]amino]-2-benzopyrone, 4-[[1-(3-phenylpropyl)piperidin-4-yl]amino]chromen-2-one, 4-[1-(3-phenyl-propyl)-piperidin-4-ylamino]-chromen-2-one
| Molecular Formula | C23H26N2O2 |
|---|---|
| Molecular Weight | 362.20 g/mol |
| LogP | 4.3021 |
| Topological Polar Surface Area | 45.48 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 6 |
| Exact Mass | 362.19943 |
| Heavy Atoms | 27 |
| Complexity | 927.7661 |
Chemical Identifiers
| CAS Number | 54729-42-9 |
|---|---|
| SMILES | C1CN(CCC1NC2=CC(=O)OC3=CC=CC=C32)CCCC4=CC=CC=C4 |
Product Overview
4-((1-(3-Phenylpropyl)-4-piperidyl)amino)-2-benzopyrone (CAS 54729-42-9), with molecular formula C23H26N2O2 and molecular weight 362.20 g/mol. IUPAC: 4-[[1-(3-phenylpropyl)piperidin-4-yl]amino]chromen-2-one.
Chemical Property Profile of 4-((1-(3-Phenylpropyl)-4-piperidyl)amino)-2-benzopyrone
Property Insights of 4-((1-(3-Phenylpropyl)-4-piperidyl)amino)-2-benzopyrone
The XLogP value of 4.3021 indicates that 4-((1-(3-Phenylpropyl)-4-piperidyl)amino)-2-benzopyrone is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 45.48 Ų, 4-((1-(3-Phenylpropyl)-4-piperidyl)amino)-2-benzopyrone exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4-((1-(3-Phenylpropyl)-4-piperidyl)amino)-2-benzopyrone has 1 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 4-((1-(3-Phenylpropyl)-4-piperidyl)amino)-2-benzopyrone?
The CAS number of 4-((1-(3-Phenylpropyl)-4-piperidyl)amino)-2-benzopyrone is 54729-42-9.
What is the molecular formula of 4-((1-(3-Phenylpropyl)-4-piperidyl)amino)-2-benzopyrone?
The molecular formula of 4-((1-(3-Phenylpropyl)-4-piperidyl)amino)-2-benzopyrone is C23H26N2O2.
What is the molecular weight of 4-((1-(3-Phenylpropyl)-4-piperidyl)amino)-2-benzopyrone?
The molecular weight of 4-((1-(3-Phenylpropyl)-4-piperidyl)amino)-2-benzopyrone is 362.20 g/mol.
Where can I buy 4-((1-(3-Phenylpropyl)-4-piperidyl)amino)-2-benzopyrone?
You can request a quote for 4-((1-(3-Phenylpropyl)-4-piperidyl)amino)-2-benzopyrone directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-((1-(3-Phenylpropyl)-4-piperidyl)amino)-2-benzopyrone?
Yes, KEHONG BIO provides custom synthesis services for 4-((1-(3-Phenylpropyl)-4-piperidyl)amino)-2-benzopyrone and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.