4-[8-Methyl[1]benzoxepino[3,4-b]pyridin-5(11H)-ylidene]piperidine-1-propanoic acid
TL;DR: 4-[8-Methyl[1]benzoxepino[3,4-b]pyridin-5(11H)-ylidene]piperidine-1-propanoic acid (CAS 732224-75-8) is a chemical compound with molecular formula C22H24N2O3 and molecular weight 364.18 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-[4-(8-methyl-5H-[1]benzoxepino[3,4-b]pyridin-11-ylidene)piperidin-1-yl]propanoic acid
Also Known As: 4-[8-Methyl[1]benzoxepino[3,4-b]pyridin-5(11H)-ylidene]piperidine-1-propanoic acid, 3-[4-(8-Methyl[1]benzoxepino[3,4-b]pyridin-5(11H)-ylidene)piperidin-1-yl]propanoic acid, 4-(8-Methyl[1]benzoxepino[3,4-b]pyridin-5(11H)-ylidene)-1-piperidinepropanoic acid, 3-(4-{13-methyl-10-oxa-7-azatricyclo[9.4.0.03,8]pentadeca-1(15),3,5,7,11,13-hexaen-2-ylidene}piperidin-1-yl)propanoic acid
| Molecular Formula | C22H24N2O3 |
|---|---|
| Molecular Weight | 364.18 g/mol |
| LogP | 3.65482 |
| Topological Polar Surface Area | 62.66 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 364.17868 |
| Heavy Atoms | 27 |
| Complexity | 894.18097 |
Chemical Identifiers
| CAS Number | 732224-75-8 |
|---|---|
| SMILES | CC1=CC2=C(C=C1)C(=C3CCN(CC3)CCC(=O)O)C4=C(CO2)N=CC=C4 |
Product Overview
4-[8-Methyl[1]benzoxepino[3,4-b]pyridin-5(11H)-ylidene]piperidine-1-propanoic acid (CAS 732224-75-8), with molecular formula C22H24N2O3 and molecular weight 364.18 g/mol. IUPAC: 3-[4-(8-methyl-5H-[1]benzoxepino[3,4-b]pyridin-11-ylidene)piperidin-1-yl]propanoic acid.
Chemical Property Profile of 4-[8-Methyl[1]benzoxepino[3,4-b]pyridin-5(11H)-ylidene]piperidine-1-propanoic acid
Property Insights of 4-[8-Methyl[1]benzoxepino[3,4-b]pyridin-5(11H)-ylidene]piperidine-1-propanoic acid
The XLogP value of 3.65482 indicates that 4-[8-Methyl[1]benzoxepino[3,4-b]pyridin-5(11H)-ylidene]piperidine-1-propanoic acid is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 62.66 Ų falls within the moderate polarity range, balancing permeability and solubility for 4-[8-Methyl[1]benzoxepino[3,4-b]pyridin-5(11H)-ylidene]piperidine-1-propanoic acid. Following Lipinski's Rule of Five, 4-[8-Methyl[1]benzoxepino[3,4-b]pyridin-5(11H)-ylidene]piperidine-1-propanoic acid 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-[8-Methyl[1]benzoxepino[3,4-b]pyridin-5(11H)-ylidene]piperidine-1-propanoic acid?
The CAS number of 4-[8-Methyl[1]benzoxepino[3,4-b]pyridin-5(11H)-ylidene]piperidine-1-propanoic acid is 732224-75-8.
What is the molecular formula of 4-[8-Methyl[1]benzoxepino[3,4-b]pyridin-5(11H)-ylidene]piperidine-1-propanoic acid?
The molecular formula of 4-[8-Methyl[1]benzoxepino[3,4-b]pyridin-5(11H)-ylidene]piperidine-1-propanoic acid is C22H24N2O3.
What is the molecular weight of 4-[8-Methyl[1]benzoxepino[3,4-b]pyridin-5(11H)-ylidene]piperidine-1-propanoic acid?
The molecular weight of 4-[8-Methyl[1]benzoxepino[3,4-b]pyridin-5(11H)-ylidene]piperidine-1-propanoic acid is 364.18 g/mol.
Where can I buy 4-[8-Methyl[1]benzoxepino[3,4-b]pyridin-5(11H)-ylidene]piperidine-1-propanoic acid?
You can request a quote for 4-[8-Methyl[1]benzoxepino[3,4-b]pyridin-5(11H)-ylidene]piperidine-1-propanoic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-[8-Methyl[1]benzoxepino[3,4-b]pyridin-5(11H)-ylidene]piperidine-1-propanoic acid?
Yes, KEHONG BIO provides custom synthesis services for 4-[8-Methyl[1]benzoxepino[3,4-b]pyridin-5(11H)-ylidene]piperidine-1-propanoic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.