2,5,6-Trichloro-4-(propan-2-ylamino)pyridine-3-carboxylic acid
TL;DR: 2,5,6-Trichloro-4-(propan-2-ylamino)pyridine-3-carboxylic acid (CAS 447456-68-0) is a chemical compound with molecular formula C9H9Cl3N2O2 and molecular weight 281.97 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2,5,6-trichloro-4-(propan-2-ylamino)pyridine-3-carboxylic acid
Also Known As: 2,5,6-TRICHLORO-4-(ISOPROPYLAMINO)NICOTINIC ACID, 2,5,6-trichloro-4-(propan-2-ylamino)pyridine-3-carboxylic acid, A2720/0115565
| Molecular Formula | C9H9Cl3N2O2 |
|---|---|
| Molecular Weight | 281.97 g/mol |
| LogP | 4.3 |
| Topological Polar Surface Area | 62.2 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 281.97296 |
| Heavy Atoms | 16 |
| Complexity | 265.0 |
Chemical Identifiers
| CAS Number | 447456-68-0 |
|---|---|
| SMILES | CC(C)NC1=C(C(=NC(=C1Cl)Cl)Cl)C(=O)O |
| InChIKey | BXDYSTUPGGXLFA-UHFFFAOYSA-N |
Product Overview
2,5,6-Trichloro-4-(propan-2-ylamino)pyridine-3-carboxylic acid (CAS 447456-68-0), with molecular formula C9H9Cl3N2O2 and molecular weight 281.97 g/mol. IUPAC: 2,5,6-trichloro-4-(propan-2-ylamino)pyridine-3-carboxylic acid.
Chemical Property Profile of 2,5,6-Trichloro-4-(propan-2-ylamino)pyridine-3-carboxylic acid
Property Insights of 2,5,6-Trichloro-4-(propan-2-ylamino)pyridine-3-carboxylic acid
The XLogP value of 4.3 indicates that 2,5,6-Trichloro-4-(propan-2-ylamino)pyridine-3-carboxylic acid is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 62.2 Ų falls within the moderate polarity range, balancing permeability and solubility for 2,5,6-Trichloro-4-(propan-2-ylamino)pyridine-3-carboxylic acid. Following Lipinski's Rule of Five, 2,5,6-Trichloro-4-(propan-2-ylamino)pyridine-3-carboxylic acid has 2 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 2,5,6-Trichloro-4-(propan-2-ylamino)pyridine-3-carboxylic acid?
The CAS number of 2,5,6-Trichloro-4-(propan-2-ylamino)pyridine-3-carboxylic acid is 447456-68-0.
What is the molecular formula of 2,5,6-Trichloro-4-(propan-2-ylamino)pyridine-3-carboxylic acid?
The molecular formula of 2,5,6-Trichloro-4-(propan-2-ylamino)pyridine-3-carboxylic acid is C9H9Cl3N2O2.
What is the molecular weight of 2,5,6-Trichloro-4-(propan-2-ylamino)pyridine-3-carboxylic acid?
The molecular weight of 2,5,6-Trichloro-4-(propan-2-ylamino)pyridine-3-carboxylic acid is 281.97 g/mol.
Where can I buy 2,5,6-Trichloro-4-(propan-2-ylamino)pyridine-3-carboxylic acid?
You can request a quote for 2,5,6-Trichloro-4-(propan-2-ylamino)pyridine-3-carboxylic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2,5,6-Trichloro-4-(propan-2-ylamino)pyridine-3-carboxylic acid?
Yes, KEHONG BIO provides custom synthesis services for 2,5,6-Trichloro-4-(propan-2-ylamino)pyridine-3-carboxylic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.