1-(1,3-Benzodioxole-5-carbonyl)piperidine-4-carboxylic acid
TL;DR: 1-(1,3-Benzodioxole-5-carbonyl)piperidine-4-carboxylic acid (CAS 198554-82-4) is a chemical compound with molecular formula C14H15NO5 and molecular weight 277.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(1,3-benzodioxole-5-carbonyl)piperidine-4-carboxylic acid
Also Known As: Maybridge3_002741, IDI1_014128, 1-(1,3-benzodioxole-5-carbonyl)piperidine-4-carboxylic acid, 1-(1,3-benzodioxol-5-ylcarbonyl)-4-piperidinecarboxylic acid, 1-(2H-1,3-benzodioxol-5-ylcarbonyl)piperidine-4-carboxylic acid
| Molecular Formula | C14H15NO5 |
|---|---|
| Molecular Weight | 277.10 g/mol |
| LogP | 1.3521 |
| Topological Polar Surface Area | 76.07 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 277.09503 |
| Heavy Atoms | 20 |
| Complexity | 548.4953 |
Chemical Identifiers
| CAS Number | 198554-82-4 |
|---|---|
| SMILES | C1CN(CCC1C(=O)O)C(=O)C2=CC3=C(C=C2)OCO3 |
Product Overview
1-(1,3-Benzodioxole-5-carbonyl)piperidine-4-carboxylic acid (CAS 198554-82-4), with molecular formula C14H15NO5 and molecular weight 277.10 g/mol. IUPAC: 1-(1,3-benzodioxole-5-carbonyl)piperidine-4-carboxylic acid.
Chemical Property Profile of 1-(1,3-Benzodioxole-5-carbonyl)piperidine-4-carboxylic acid
Property Insights of 1-(1,3-Benzodioxole-5-carbonyl)piperidine-4-carboxylic acid
The XLogP value of 1.3521 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-(1,3-Benzodioxole-5-carbonyl)piperidine-4-carboxylic acid. The TPSA of 76.07 Ų falls within the moderate polarity range, balancing permeability and solubility for 1-(1,3-Benzodioxole-5-carbonyl)piperidine-4-carboxylic acid. Following Lipinski's Rule of Five, 1-(1,3-Benzodioxole-5-carbonyl)piperidine-4-carboxylic 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 1-(1,3-Benzodioxole-5-carbonyl)piperidine-4-carboxylic acid?
The CAS number of 1-(1,3-Benzodioxole-5-carbonyl)piperidine-4-carboxylic acid is 198554-82-4.
What is the molecular formula of 1-(1,3-Benzodioxole-5-carbonyl)piperidine-4-carboxylic acid?
The molecular formula of 1-(1,3-Benzodioxole-5-carbonyl)piperidine-4-carboxylic acid is C14H15NO5.
What is the molecular weight of 1-(1,3-Benzodioxole-5-carbonyl)piperidine-4-carboxylic acid?
The molecular weight of 1-(1,3-Benzodioxole-5-carbonyl)piperidine-4-carboxylic acid is 277.10 g/mol.
Where can I buy 1-(1,3-Benzodioxole-5-carbonyl)piperidine-4-carboxylic acid?
You can request a quote for 1-(1,3-Benzodioxole-5-carbonyl)piperidine-4-carboxylic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-(1,3-Benzodioxole-5-carbonyl)piperidine-4-carboxylic acid?
Yes, KEHONG BIO provides custom synthesis services for 1-(1,3-Benzodioxole-5-carbonyl)piperidine-4-carboxylic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.