1-(4-Nitrobenzoyl)-4-piperidinecarboxylic acid
TL;DR: 1-(4-Nitrobenzoyl)-4-piperidinecarboxylic acid (CAS 303994-58-3) is a chemical compound with molecular formula C13H14N2O5 and molecular weight 278.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(4-nitrobenzoyl)piperidine-4-carboxylic acid
Also Known As: 1-(4-nitrobenzoyl)-4-piperidinecarboxylic acid, 1-(4-nitrobenzoyl)piperidine-4-carboxylic acid, 9597AD, 1- PIPERIDINE-4-CARBOXYLICACID, 1-(4-nitrobenzoyl)piperidine-4-carboxylicacid
| Molecular Formula | C13H14N2O5 |
|---|---|
| Molecular Weight | 278.09 g/mol |
| LogP | 1.2 |
| Topological Polar Surface Area | 103.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 2 |
| Exact Mass | 278.09027 |
| Heavy Atoms | 20 |
| Complexity | 390.0 |
Chemical Identifiers
| CAS Number | 303994-58-3 |
|---|---|
| SMILES | C1CN(CCC1C(=O)O)C(=O)C2=CC=C(C=C2)[N+](=O)[O-] |
| InChIKey | VFTSLMZECVJNRT-UHFFFAOYSA-N |
Product Overview
1-(4-Nitrobenzoyl)-4-piperidinecarboxylic acid (CAS 303994-58-3), with molecular formula C13H14N2O5 and molecular weight 278.09 g/mol. IUPAC: 1-(4-nitrobenzoyl)piperidine-4-carboxylic acid.
Chemical Property Profile of 1-(4-Nitrobenzoyl)-4-piperidinecarboxylic acid
Property Insights of 1-(4-Nitrobenzoyl)-4-piperidinecarboxylic acid
The XLogP value of 1.2 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-(4-Nitrobenzoyl)-4-piperidinecarboxylic acid. The TPSA of 103.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 1-(4-Nitrobenzoyl)-4-piperidinecarboxylic acid. Following Lipinski's Rule of Five, 1-(4-Nitrobenzoyl)-4-piperidinecarboxylic acid has 1 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 1-(4-Nitrobenzoyl)-4-piperidinecarboxylic acid?
The CAS number of 1-(4-Nitrobenzoyl)-4-piperidinecarboxylic acid is 303994-58-3.
What is the molecular formula of 1-(4-Nitrobenzoyl)-4-piperidinecarboxylic acid?
The molecular formula of 1-(4-Nitrobenzoyl)-4-piperidinecarboxylic acid is C13H14N2O5.
What is the molecular weight of 1-(4-Nitrobenzoyl)-4-piperidinecarboxylic acid?
The molecular weight of 1-(4-Nitrobenzoyl)-4-piperidinecarboxylic acid is 278.09 g/mol.
Where can I buy 1-(4-Nitrobenzoyl)-4-piperidinecarboxylic acid?
You can request a quote for 1-(4-Nitrobenzoyl)-4-piperidinecarboxylic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-(4-Nitrobenzoyl)-4-piperidinecarboxylic acid?
Yes, KEHONG BIO provides custom synthesis services for 1-(4-Nitrobenzoyl)-4-piperidinecarboxylic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.